SCHEMBL1367950

SCHEMBL1367950

Cc1ccc(NC(=O)c2cccc(-c3ccccc3)c2)cc1C(=O)Nc1cnc2[nH]cnc2c1

nearest known ligand 0.61

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
BTK Q06187 10/20 0.61
BLK P51451 7/20 0.61
LCK P06239 4/20 0.52
NPC1 O15118 1/20 0.50
RAB9A P51151 1/20 0.50
SMN1; SMN2 Q16637 1/20 0.50
KDR P35968 1/20 0.50
MAPK14 Q16539 1/20 0.50
BRAF P15056 7/20 0.49
CYP2C9 P11712 2/20 0.49
CSF1R P07333 1/20 0.48

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
SCHEMBL1367507 0.93 BLK (0.58) BTKBLKLCKNPC1RAB9A
SCHEMBL1367567 0.93 NPC1 (0.52) BTKBLKLCKNPC1RAB9A
SCHEMBL1136398 0.86 BTK (0.59) BTKBLKLCKKDRMAPK14
SCHEMBL1367508 0.81 BTK (0.60) BTKNPC1RAB9ASMN1; SMN2
SCHEMBL1367511 0.81 BTK (0.60) BTKNPC1RAB9ASMN1; SMN2
SCHEMBL1136378 0.79 MMP2 (0.53) BTKBLKLCKNPC1RAB9A
SCHEMBL3993077 0.78 SMN1; SMN2 (0.48) BTKLCKNPC1RAB9ASMN1; SMN2
SCHEMBL1367088 0.78 BLK (0.45) BTKBLKLCKNPC1RAB9A
SCHEMBL1136409 0.78 BLK (0.57) BTKBLKNPC1RAB9A
SCHEMBL27755013 0.77 BTK (0.45) BTKLCKNPC1RAB9ASMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8067599-B2 Imidazo [4,5-B] pyridine and pyrrolo [2,3-B] pyridine protein kinase inhibitors HOFFMAN-LA ROCHE INC. (US) 2011-11-29 US claimed
US-20090318428-A1 HETEROARYL DERIVATIVES AS PROTEIN KINASE INHIBITORS HOFFMANN-LA ROCHE, INC. 2009-12-24 US claimed
US-8067599-B2 Imidazo [4,5-B] pyridine and pyrrolo [2,3-B] pyridine protein kinase inhibitors HOFFMAN-LA ROCHE INC. (US) 2011-11-29 US disclosed
US-20090318428-A1 HETEROARYL DERIVATIVES AS PROTEIN KINASE INHIBITORS HOFFMANN-LA ROCHE, INC. 2009-12-24 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 (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-20090318428-A1 HETEROARYL DERIVATIVES AS PROTEIN KINASE INHIBITORS MAP3K5, MAP3K1, PRKACA BTK 334/4885BLK 191/4885LCK 185/4885

“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.