SCHEMBL17909895

SCHEMBL17909895

Cc1ccc2ccc(-c3c(C(N)=O)ccnc3C)cc2n1

nearest known ligand 0.46

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ SYK P43405 1/20 0.42
▸ PARP1 P09874 1/20 0.41
▸ PIK3CB P42338 1/20 0.39
▸ CYP1A2 P05177 1/20 0.39
▸ KDR P35968 1/20 0.39
▸ TGFBR1 P36897 1/20 0.39
▸ MAPK14 Q16539 1/20 0.39

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
SCHEMBL17909864 0.91 SYK (0.48) SYKPARP1PIK3CBCYP1A2KDR
SCHEMBL17909893 0.83 SYK (0.41) SYKPARP1PIK3CBCYP1A2KDR
SCHEMBL17909883 0.78 SYK (0.38) SYKPARP1PIK3CBKDRTGFBR1
SCHEMBL17909822 0.78 SLC2A1 (0.43) PARP1PIK3CBKDRTGFBR1MAPK14
SCHEMBL17909840 0.76 PARP1 (0.46) PARP1PIK3CBCYP1A2KDRTGFBR1
SCHEMBL18426561 0.76 AAK1 (0.39) SYKPARP1PIK3CBKDRTGFBR1
SCHEMBL17909860 0.75 NQO1 (0.42) SYKPARP1KDRTGFBR1MAPK14
SCHEMBL27890736 0.75 MKNK1 (0.46) —
SCHEMBL17909902 0.75 F12 (0.47) PARP1PIK3CB
SCHEMBL17909846 0.74 KDM4E (0.40) SYKPARP1PIK3CBKDRTGFBR1

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 9 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11021463-B2 Therapeutic inhibitory compounds ATTUNE PHARMACEUTICALS, INC. (US) 2021-06-01 — — US disclosed
US-20200031800-A1 THERAPEUTIC INHIBITORY COMPOUNDS ATTUNE PHARMACEUTICALS, INC. 2020-01-30 — — US disclosed
US-20200031799-A1 THERAPEUTIC INHIBITORY COMPOUNDS ATTUNE PHARMACEUTICALS, INC. 2020-01-30 — — US disclosed
US-10266515-B2 Therapeutic inhibitory compounds LIFESCI PHARMACEUTICALS, INC. (BB) 2019-04-23 — — US disclosed
US-10259803-B2 Therapeutic inhibitory compounds LIFESCI PHARMACEUTICALS, INC. (BB) 2019-04-16 — — US disclosed
US-20180170906-A1 THERAPEUTIC INHIBITORY COMPOUNDS ATTUNE PHARMACEUTICALS, INC. 2018-06-21 — — US disclosed
US-20170260163-A1 THERAPEUTIC INHIBITORY COMPOUNDS ATTUNE PHARMACEUTICALS, INC. 2017-09-14 — — US disclosed
US-9611252-B2 Therapeutic inhibitory compounds LIFESCI PHARMACEUTICALS, INC. (BB) 2017-04-04 — — US disclosed
US-20160200704-A1 THERAPEUTIC INHIBITORY COMPOUNDS ATTUNE PHARMACEUTICALS, INC. 2016-07-14 — — US 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 (8 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-20200031800-A1 THERAPEUTIC INHIBITORY COMPOUNDS KLKB1, SERPINB1, SERPINE1 SYK 1810/4885PARP1 1139/4885PIK3CB 478/4885
US-20200031799-A1 THERAPEUTIC INHIBITORY COMPOUNDS KLKB1, SERPINB1, SERPINE1 SYK 1810/4885PARP1 1139/4885PIK3CB 478/4885
US-20180170906-A1 THERAPEUTIC INHIBITORY COMPOUNDS KLKB1, SERPINB1, SERPINE1 SYK 1810/4885PARP1 1139/4885PIK3CB 478/4885
US-20170260163-A1 THERAPEUTIC INHIBITORY COMPOUNDS KLKB1, SERPINB1, SERPINE1 SYK 1810/4885PARP1 1139/4885PIK3CB 478/4885
US-20160200704-A1 THERAPEUTIC INHIBITORY COMPOUNDS KLKB1, SERPINB1, SERPINE1 SYK 1810/4885PARP1 1139/4885PIK3CB 478/4885
US-10266515-B2 Therapeutic inhibitory compounds KLKB1, SERPINB1, SERPINE1 SYK 1810/4885PARP1 1139/4885PIK3CB 478/4885
US-10259803-B2 Therapeutic inhibitory compounds KLKB1, SERPINB1, SERPINE1 SYK 1810/4885PARP1 1139/4885PIK3CB 478/4885
US-11021463-B2 Therapeutic inhibitory compounds KLKB1, SERPINB1, SERPINE1 SYK 1810/4885PARP1 1139/4885PIK3CB 478/4885

“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.

Send feedback