SCHEMBL2380402

SCHEMBL2380402

COc1ccc(-c2ccc3cc(NC(=O)c4ccsc4)ccc3c2)cc1C(N)=O

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ NPC1 O15118 4/20 0.50
▸ RAB9A P51151 4/20 0.50
▸ CASP3 P42574 2/20 0.50
▸ SENP7 Q9BQF6 2/20 0.50
▸ NQO2 P16083 1/20 0.50
▸ PLAU P00749 3/20 0.49
▸ PLAT P00750 2/20 0.49
▸ SMN1; SMN2 Q16637 2/20 0.47
▸ MAPT P10636 1/20 0.47
▸ CYP1A2 P05177 1/20 0.47
▸ POLB P06746 1/20 0.47
▸ CYP3A4 P08684 1/20 0.47
▸ TNIK Q9UKE5 2/20 0.47
▸ AXL P30530 1/20 0.46
▸ KDM4E B2RXH2 1/20 0.46
▸ NPSR1 Q6W5P4 1/20 0.46
▸ ALDH1A1 P00352 1/20 0.46
▸ TP53 P04637 1/20 0.46
▸ PLG P00747 1/20 0.45
▸ SENP8 Q96LD8 1/20 0.45

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
SCHEMBL2381767 0.78 KCNK3 (0.47) NPC1RAB9APLAUPLATTNIK
SCHEMBL2381882 0.78 MAPK14 (0.43) NPC1RAB9APLAUPLATTNIK
SCHEMBL2382094 0.76 MAPK14 (0.56) NPC1RAB9APLAUPLATTNIK
SCHEMBL18030783 0.73 KDM4E (0.65) NPC1RAB9ASMN1; SMN2MAPTCYP1A2
SCHEMBL2382186 0.73 ESR1 (0.53) NPC1RAB9AMAPTKMT2AKCNK3
SCHEMBL2382379 0.73 NPC1 (0.58) NPC1RAB9AMAPTKCNK3KCNK9
SCHEMBL12297409 0.72 KCNK3 (0.57) NPC1RAB9ACASP3SENP7NQO2
SCHEMBL2382404 0.71 NPC1 (0.60) NPC1RAB9AKMT2AMEN1
SCHEMBL2380312 0.71 CDK7 (0.45) NPC1RAB9ATNIKKMT2AKCNK3
SCHEMBL14603093 0.70 KMT2A (0.43) NPC1RAB9ACASP3SENP7POLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8017601-B2 Bis-aryl kinase inhibitors and method AMGEN INC. (US) 2011-09-13 — — US disclosed
US-8017601-B2 Bis-aryl kinase inhibitors and method AMGEN INC. (US) 2011-09-13 — — US disclosed
US-8017601-B2 Bis-aryl kinase inhibitors and method AMGEN INC. (US) 2011-09-13 — — US disclosed
US-20070054903-A1 Bis-aryl kinase inhibitors and method AMGEN INC. (US) 2007-03-08 — — US disclosed
US-20070054903-A1 Bis-aryl kinase inhibitors and method AMGEN INC. (US) 2007-03-08 — — US disclosed
US-20070054903-A1 Bis-aryl kinase inhibitors and method AMGEN INC. (US) 2007-03-08 — — US disclosed
WO-2007005668-A2 BIS-ARYL KINASE INHIBITORS AND THEIR USE IN THE TREATMENT OF INFLAMMATION, ANGIOGENESIS AND CANCER AMGEN INC. (US) 2007-01-11 — — WO 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 (1 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-20070054903-A1 Bis-aryl kinase inhibitors and method HGF, MET, BLK NPC1 1163/4885RAB9A 1962/4885CASP3 2365/4885

“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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