Isopropylamine

Isopropylamine

SCHEMBL5359356

CC(C)N.O=C(O)N1CC=C(c2cc3c(Nc4ccc5ncsc5c4)ncnc3[nH]2)CC1

nearest known ligand 0.39

Full drug profile on Sugi Atlas →

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ SYK P43405 3/20 0.39
▸ CCNT1 O60563 10/20 0.38
▸ CDK9 P50750 10/20 0.38
▸ BTK Q06187 6/20 0.38
▸ PRKD1 Q15139 1/20 0.37

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
SCHEMBL5001595 0.97 CCNT1 (0.38) CCNT1CDK9BTKPRKD1
SCHEMBL5004683 0.91 CCNT1 (0.48) SYKCCNT1CDK9
SCHEMBL13994144 0.91 CCNT1 (0.48) CCNT1CDK9BTK
SCHEMBL5010180 0.90 RIPK2 (0.45) —
SCHEMBL5010242 0.90 CCNT1 (0.38) SYKCCNT1CDK9BTK
SCHEMBL13994165 0.89 CCNT1 (0.41) CCNT1CDK9BTK
SCHEMBL5008417 0.89 KCNH2 (0.42) SYKCCNT1CDK9BTK
SCHEMBL5004735 0.88 CCNT1 (0.40) CCNT1CDK9BTK
SCHEMBL13994111 0.88 CCNT1 (0.41) CCNT1CDK9PRKD1
SCHEMBL13994106 0.88 CCNT1 (0.43) CCNT1CDK9

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
EP-1797054-A2 ARYL-AMINO SUBSTITUTED PYRROLOPYRIMIDINE MULTI-KINASE INHIBITING COMPOUNDS OSI Pharmaceuticals, Inc. (US) 2007-06-20 — — EP disclosed
WO-2006017443-A2 ARYL-AMINO SUBSTITUTED PYRROLOPYRIMIDINE MULTI-KINASE INHIBITING COMPOUNDS OSI PHARMACEUTICALS, INC. (US) 2006-02-16 — — WO disclosed
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