SCHEMBL10169158

SCHEMBL10169158

Cc1ccc(C(N)=O)c(Nc2ccc(C(=O)N3CCN(C)CC3)cc2)n1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BTK Q06187 5/20 0.53
SYK P43405 3/20 0.48
PDGFRB P09619 2/20 0.47
PDGFRA P16234 1/20 0.47
CCNT1 O60563 1/20 0.47
CDK4 P11802 1/20 0.47
CCND1 P24385 1/20 0.47
CDK9 P50750 1/20 0.47
CDK6 Q00534 1/20 0.47
CDK11A Q9UQ88 1/20 0.47
SRC P12931 2/20 0.46
EPHX2 P34913 2/20 0.46
EPHB4 P54760 1/20 0.46
BRD4 O60885 1/20 0.46
CREBBP Q92793 1/20 0.46
HPGD P15428 1/20 0.46
ALOX15 P16050 1/20 0.46
CAMK2D Q13557 1/20 0.45
POLB P06746 1/20 0.45
CDK2 P24941 2/20 0.44

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
SCHEMBL10168754 0.88 BTK (0.68) BTKSYKHPGD
SCHEMBL894676 0.88 CCNT1 (0.51) BTKSYKPDGFRBPDGFRACCNT1
SCHEMBL10169167 0.84 SYK (0.56) BTKSYKCCNT1CDK4CCND1
SCHEMBL20998653 0.82 BTK (0.80) BTKSYK
SCHEMBL16676665 0.82 BTK (0.80) BTKSYK
SCHEMBL18068351 0.82 BTK (0.69) BTKSYK
Hydrochloric Acid SCHEMBL18044921 0.81 BTK (0.79) BTKSYK
Hydrochloric Acid SCHEMBL16671785 0.81 BTK (0.79) BTKSYK
SCHEMBL16670806 0.81 BTK (0.67) BTK
SCHEMBL893931 0.79 BTK (0.53) BTKSYKCCNT1CDK9EPHX2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8586751-B2 Nicotinamide compounds useful as kinase modulators BRISTOL-MYERS SQUIBB COMPANY (US) 2013-11-19 US disclosed
US-20120082702-A1 NICOTINAMIDE COMPOUNDS USEFUL AS KINASE MODULATORS BRISTOL-MEYERS SQUIBB COMPANY 2012-04-05 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-20120082702-A1 NICOTINAMIDE COMPOUNDS USEFUL AS KINASE MODULATORS NADK, BTK, NAMPT BTK 2/4885SYK 22/4885PDGFRB 939/4885

“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.