SCHEMBL20447299

SCHEMBL20447299

COC(=O)Nc1nccc(-c2cnc(F)c(C)c2)n1

nearest known ligand 0.58

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ AAK1 Q2M2I8 14/20 0.58
▸ ABL1 P00519 3/20 0.40
▸ BCR P11274 3/20 0.40
▸ PDGFRB P09619 1/20 0.40
▸ PDGFRA P16234 1/20 0.40
▸ PIK3C3 Q8NEB9 1/20 0.40
▸ SRC P12931 1/20 0.39
▸ NPC1 O15118 1/20 0.39
▸ POLB P06746 1/20 0.39
▸ RAB9A P51151 1/20 0.39
▸ KMT2A Q03164 1/20 0.39
▸ SMN1; SMN2 Q16637 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
SCHEMBL20447425 0.89 AAK1 (0.46) AAK1ABL1BCRPDGFRBPDGFRA
SCHEMBL21508206 0.87 AAK1 (0.59) AAK1ABL1BCR
SCHEMBL21508477 0.82 AAK1 (0.59) AAK1ABL1BCRPIK3C3SRC
SCHEMBL21508471 0.79 AAK1 (0.58) AAK1ABL1
SCHEMBL28487905 0.77 KMO (0.39) AAK1
SCHEMBL21508541 0.77 AAK1 (0.69) AAK1
SCHEMBL21508680 0.76 AAK1 (0.66) AAK1
SCHEMBL20446748 0.75 AAK1 (0.56) AAK1ABL1BCRPIK3C3
SCHEMBL20447482 0.75 KMO (0.45) AAK1ABL1BCRPDGFRBPDGFRA
SCHEMBL21508497 0.74 AAK1 (0.56) AAK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-112142655-A Biaryl kinase inhibitors 百时美施贵宝公司 2020-12-29 — — CN disclosed
CN-108368084-B Biaryl kinase inhibitors 百时美施贵宝公司 2020-10-16 — — CN disclosed
US-10544120-B2 Biaryl kinase inhibitors BRISTOL-MYERS SQUIBB COMPANY (US) 2020-01-28 — — US disclosed
EP-3356340-B1 BIARYL KINASE INHIBITORS BRISTOL MYERS SQUIBB CO (US) 2019-10-23 — — EP disclosed
EP-3356340-A1 BIARYL KINASE INHIBITORS Bristol-Myers Squibb Company (US) 2018-08-08 — — EP 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-10544120-B2 Biaryl kinase inhibitors AAK1, CAMKK1, CAMKK2 AAK1 1/4885ABL1 172/4885BCR 746/4885

“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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