SCHEMBL1916309

SCHEMBL1916309

Cc1ccc(-c2cs[c]n2)cc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 4/20 0.47
▸ POLB P06746 1/20 0.47
▸ NOTUM Q6P988 1/20 0.47
▸ RAB9A P51151 9/20 0.41
▸ NPC1 O15118 7/20 0.41
▸ SMN1; SMN2 Q16637 5/20 0.41
▸ KDM4E B2RXH2 3/20 0.41
▸ SREBF2 Q12772 2/20 0.41
▸ LTA4H P09960 1/20 0.39
▸ METAP2 P50579 1/20 0.38
▸ METAP1 P53582 1/20 0.38
▸ MAPT P10636 3/20 0.38
▸ GFER P55789 2/20 0.38
▸ ENPP3 O14638 1/20 0.37
▸ ENPP1 P22413 1/20 0.37
▸ LMNA P02545 2/20 0.37
▸ NFKB1 P19838 1/20 0.37
▸ NFKB2 Q00653 1/20 0.37
▸ RELA Q04206 1/20 0.37
▸ CASP3 P42574 1/20 0.37

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
SCHEMBL6247506 0.89 TEAD4 (0.40) KMT2APOLBNOTUMRAB9ANPC1
SCHEMBL1915529 0.80 METAP2 (0.44) KMT2APOLBRAB9ANPC1SMN1; SMN2
SCHEMBL5540279 0.79 RAB9A (0.47) KMT2ANOTUMRAB9ANPC1SMN1; SMN2
SCHEMBL468044 0.79 RAB9A (0.41) KMT2ANOTUMRAB9ANPC1SMN1; SMN2
SCHEMBL7228611 0.79 RAB9A (0.44) KMT2APOLBRAB9ANPC1SMN1; SMN2
SCHEMBL500232 0.79 RAB9A (0.46) KMT2ARAB9ANPC1SMN1; SMN2KDM4E
SCHEMBL10515566 0.79 LTA4H (0.46) KMT2APOLBRAB9ANPC1SMN1; SMN2
SCHEMBL17626009 0.79 ALDH1A1 (0.40) KMT2APOLBRAB9ANPC1SMN1; SMN2
SCHEMBL679068 0.79 NPC1 (0.50) KMT2APOLBRAB9ANPC1SMN1; SMN2
SCHEMBL17626108 0.79 KIF11 (0.40) KMT2ARAB9ANPC1SMN1; SMN2MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113929696-B Acyl thiourea psoralen derivatives, and preparation method and application thereof 南开大学 2024-05-14 — — CN claimed
CN-113929696-A Acylthiourea psoralen derivatives, and preparation method and application thereof 南开大学 2022-01-14 — — CN claimed
CN-102245574-A Compounds, pharmaceutical compositions and methods for treating metabolic disorders EUROSCREEN SA 2011-11-16 — — CN claimed
US-20110230477-A1 COMPOUNDS, PHARMACEUTICAL COMPOSITION AND METHODS FOR USE IN TREATING METABOLIC DISORDERS EUROSCREEN S.A. (BE) 2011-09-22 — — US claimed
EP-2364297-A1 Compounds, pharmaceutical composition and methods for use in treating metabolic disorders Euroscreen S.A. (BE) 2011-09-14 — — EP claimed
WO-2011076734-A1 COMPOUNDS, PHARMACEUTICAL COMPOSITION AND METHODS FOR USE IN TREATING INFLAMMATORY DISEASES EUROSCREEN S.A. (BE) 2011-06-30 — — WO claimed
WO-2011076732-A1 COMPOUNDS, PHARMACEUTICAL COMPOSITION AND METHODS FOR USE IN TREATING GASTROINTESTINAL DISORDERS EUROSCREEN S.A. (BE) 2011-06-30 — — WO claimed
WO-2010066682-A1 COMPOUNDS, PHARMACEUTICAL COMPOSITION AND METHODS FOR USE IN TREATING METABOLIC DISORDERS EUROSCREEN S.A. (BE) 2010-06-17 — — WO claimed
CN-1170813-C N2 phenylamidine derivatives �ݶ�ũ�����޹�˾ 2004-10-13 — — CN claimed
CN-113929696-B Acyl thiourea psoralen derivatives, and preparation method and application thereof 南开大学 2024-05-14 — — CN disclosed
CN-113929696-A Acylthiourea psoralen derivatives, and preparation method and application thereof 南开大学 2022-01-14 — — CN disclosed
US-20180244699-A1 1-HYDROXY-3H-2,1-BENZOXABOROLE DERIVATIVES AND THEIR USE AS MICROBIOCIDES SYNGENTA PARTICIPATIONS AG (CH) 2018-08-30 — — US disclosed
EP-2931280-B1 METHODS AND COMPOSITIONS FOR INHIBITING CNKSR1 PHUSIS THERAPEUTICS INC (US) 2018-02-14 — — EP disclosed
US-20170000133-A1 BENZOXABOROLE FUNGICIDES SYNGENTA PARTICIPATIONS AG (SE) 2017-01-05 — — US disclosed
CN-1170813-C N2 phenylamidine derivatives �ݶ�ũ�����޹�˾ 2004-10-13 — — CN disclosed
US-20040058921-A1 Morpholine derivatives as antagonists of orexin receptors SMITHKLINE BEECHAM PLC (GB) 2004-03-25 — — US disclosed
EP-1353918-A1 MORPHOLINE DERIVATIVES AS ANTAGONISTS OF OREXIN RECEPTORS SMITHKLINE BEECHAM PLC (GB) 2003-10-22 — — EP disclosed
US-6605631-B1 Controlling fungi and pests; improved activity and plant tolerability BASF AKTIENGESELLSCHAFT (DE) 2003-08-12 — — US disclosed
WO-2002044172-A1 MORPHOLINE DERIVATIVES AS ANTAGONISTS OF OREXIN RECEPTORS SMITHKLINE BEECHAM P.L.C. (GB) 2002-06-06 — — WO disclosed
CN-1342137-A N2 phenylamidine derivatives AFINDY AGRICULTURAL SCIENCES G (DE) 2002-03-27 — — 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 (4 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-20180244699-A1 1-HYDROXY-3H-2,1-BENZOXABOROLE DERIVATIVES AND THEIR USE AS MICROBIOCIDES CBR3, HCRTR2, HCAR3 KMT2A 2535/4885POLB 2986/4885NOTUM 2367/4885
US-20110230477-A1 COMPOUNDS, PHARMACEUTICAL COMPOSITION AND METHODS FOR USE IN TREATING METABOLIC DISORDERS CPT1A, LIPC, PC KMT2A 3648/4885POLB 2275/4885NOTUM 288/4885
US-20170000133-A1 BENZOXABOROLE FUNGICIDES CYP4X1, BROX, CYP1B1 KMT2A 2550/4885POLB 1765/4885NOTUM 877/4885
US-20040058921-A1 Morpholine derivatives as antagonists of orexin receptors HCRTR2, HCRTR1, OXTR KMT2A 1246/4885POLB 4725/4885NOTUM 3323/4885

“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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