SCHEMBL2696603

SCHEMBL2696603

COc1ccc(C2=C[N]C=N2)cc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CA12 O43570 1/20 0.44
▸ CA1 P00915 1/20 0.44
▸ CA2 P00918 1/20 0.44
▸ CA7 P43166 1/20 0.44
▸ CA9 Q16790 1/20 0.44
▸ CA14 Q9ULX7 1/20 0.44
▸ CLK4 Q9HAZ1 1/20 0.42
▸ ESR2 Q92731 1/20 0.42
▸ DYRK1A Q13627 2/20 0.42
▸ MAPT P10636 2/20 0.41
▸ KDM4E B2RXH2 2/20 0.41
▸ TP53 P04637 2/20 0.41
▸ APP P05067 1/20 0.41
▸ NPC1 O15118 4/20 0.41
▸ RAB9A P51151 4/20 0.41
▸ SMN1; SMN2 Q16637 2/20 0.41
▸ ALDH1A1 P00352 1/20 0.41
▸ POLB P06746 1/20 0.41
▸ ME2 P23368 1/20 0.40
▸ ME1 P48163 1/20 0.40

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL8654425 0.78 DYRK1A (0.50) CLK4DYRK1AMAPTKDM4ETP53
SCHEMBL2090042 0.73 CA12 (0.46) CA12CA1CA2CA7CA9
SCHEMBL197522 0.69 CA1 (0.79) CA12CA1CA2CA7CA9
SCHEMBL6733562 0.69 CA1 (0.79) CA12CA1CA2CA7CA9
SCHEMBL9151672 0.69 CA1 (0.79) CA12CA1CA2CA7CA9
SCHEMBL19100022 0.68 CA12 (0.44) CA12CA1CA2CA7CA9
SCHEMBL28890215 0.67 CA1 (0.73) CA12CA1CA2CA7CA9
Iodide SCHEMBL28861996 0.67 CA1 (0.73) CA12CA1CA2CA7CA9
SCHEMBL4094356 0.67 KDM4E (0.71) CA12CA1CA2CA7CA9
SCHEMBL29733664 0.67 KDM4E (0.71) CA12CA1CA2CA7CA9

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 27 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240156792-A1 COMBINATION THERAPY USING AZABICYCLO COMPOUND FOR CANCER TAIHO PHARMACEUTICAL CO., LTD. (JP) 2024-05-16 — — US disclosed
US-11918562-B2 Combination therapy using azabicyclo compound for cancer TAIHO PHARMACEUTICAL CO., LTD. (JP) 2024-03-05 — — US disclosed
US-20220016090-A1 COMBINATION THERAPY USING AZABICYCLO COMPOUND FOR CANCER TAIHO PHARMACEUTICAL CO., LTD. (JP) 2022-01-20 — — US disclosed
US-11166943-B2 Combination therapy using azabicyclo compound for cancer TAIHO PHARMACEUTICAL CO., LTD. (JP) 2021-11-09 — — US disclosed
US-10849886-B2 Combination therapy using azabicyclo compound for cancer TAIHO PHARMACEUTICAL CO., LTD. (JP) 2020-12-01 — — US disclosed
US-20200281904-A1 PROPHYLACTIC AND/OR THERAPEUTIC AGENT FOR DISEASES INVOLVING IDO EXPRESSION TAIHO PHARMACEUTICAL CO., LTD. (JP) 2020-09-10 — — US disclosed
US-20200276171-A1 COMBINATION THERAPY USING AZABICYCLO COMPOUND FOR CANCER TAIHO PHARMACEUTICAL CO., LTD. (JP) 2020-09-03 — — US disclosed
EP-3682900-A1 PROPHYLACTIC AND/OR THERAPEUTIC AGENT FOR DISEASES INVOLVING IDO EXPRESSION Taiho Pharmaceutical Co., Ltd. (JP) 2020-07-22 — — EP disclosed
EP-3646869-A1 CHEMOTHERAPY FOR CANCER USING AZABICYCLO COMPOUND Taiho Pharmaceutical Co., Ltd. (JP) 2020-05-06 — — EP disclosed
CN-111107876-A Prophylactic and/or therapeutic agent for diseases in which IDO expression is involved 大鹏药品工业株式会社 2020-05-05 — — CN disclosed
US-20160228417-A1 COMBINATION THERAPY USING AZABICYCLO COMPOUND FOR CANCER TAIHO PHARMACEUTICAL CO., LTD. (JP) 2016-08-11 — — US disclosed
EP-3053578-A1 COMBINATION CANCER THERAPY USING AZABICYCLO COMPOUND Taiho Pharmaceutical Co., Ltd. (JP) 2016-08-10 — — EP disclosed
US-9273045-B2 Azabicyclo compound and salt thereof TAIHO PHARMACEUTICAL CO., LTD. (JP) 2016-03-01 — — US disclosed
EP-2452940-B1 AZABICYCLO COMPOUND AND SALT THEREOF TAIHO PHARMACEUTICAL CO LTD (JP) 2014-12-17 — — EP disclosed
US-20140303162-A1 AZABICYCLO COMPOUND AND SALT THEREOF TAIHO PHARMACEUTICAL CO., LTD. (JP) 2014-10-09 — — US disclosed
US-8779142-B2 Azabicyclo compound and salt thereof TAIHO PHARMACEUTICAL CO., LTD. (JP) 2014-07-15 — — US disclosed
EP-2452940-A1 AZABICYCLO COMPOUND AND SALT THEREOF Taiho Pharmaceutical Co., Ltd. (JP) 2012-05-16 — — EP disclosed
US-20120108589-A1 AZABICYCLO COMPOUND AND SALT THEREOF TAIHO PHARMACEUTICAL CO., LTD. (JP) 2012-05-03 — — US disclosed
CN-1066150-C Bridged indoles as matrix metalloprotease inhibitors SYNTEX INC (US) 2001-05-23 — — CN disclosed
CN-1180358-A Bridged indoles as matrix metalloprotease inhibitors SYNTEX INC (US) 1998-04-29 — — CN disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (10 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20140303162-A1 AZABICYCLO COMPOUND AND SALT THEREOF HSP90AB1, HSP90AB2P, HSP90AA1 CA12 2723/4885CA1 1691/4885CA2 686/4885
US-20240156792-A1 COMBINATION THERAPY USING AZABICYCLO COMPOUND FOR CANCER HSP90AB1, HSP90AA1, HSP90AB2P CA12 3176/4885CA1 2696/4885CA2 2262/4885
US-20160228417-A1 COMBINATION THERAPY USING AZABICYCLO COMPOUND FOR CANCER HSP90AB1, HSP90AA1, HSP90AB2P CA12 3176/4885CA1 2696/4885CA2 2262/4885
US-20120108589-A1 AZABICYCLO COMPOUND AND SALT THEREOF HSP90AB1, HSP90AB2P, HSP90AA1 CA12 2723/4885CA1 1691/4885CA2 686/4885
US-11918562-B2 Combination therapy using azabicyclo compound for cancer HSP90AB1, HSP90AA1, HSP90AB2P CA12 3176/4885CA1 2696/4885CA2 2262/4885
US-10849886-B2 Combination therapy using azabicyclo compound for cancer HSP90AB1, HSP90AA1, HSP90AB2P CA12 3176/4885CA1 2696/4885CA2 2262/4885
US-20200276171-A1 COMBINATION THERAPY USING AZABICYCLO COMPOUND FOR CANCER HSP90AB1, HSP90AA1, HSP90AB2P CA12 3176/4885CA1 2696/4885CA2 2262/4885
US-20220016090-A1 COMBINATION THERAPY USING AZABICYCLO COMPOUND FOR CANCER HSP90AB1, HSP90AA1, HSP90AB2P CA12 3176/4885CA1 2696/4885CA2 2262/4885
US-11166943-B2 Combination therapy using azabicyclo compound for cancer HSP90AB1, HSP90AA1, HSP90AB2P CA12 3176/4885CA1 2696/4885CA2 2262/4885
US-20200281904-A1 PROPHYLACTIC AND/OR THERAPEUTIC AGENT FOR DISEASES INVOLVING IDO EXPRESSION IDO1, IDO2, HSP90AB1 CA12 3490/4885CA1 3484/4885CA2 4104/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.

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