SCHEMBL14375500

SCHEMBL14375500

CC(=O)Nc1cc(C2CC2)nn1C(C)C

nearest known ligand 0.40

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 1/20 0.40
▸ KMT2A Q03164 1/20 0.40
▸ GAA P10253 2/20 0.40
▸ CYP3A4 P08684 1/20 0.40
▸ CYP2C19 P33261 1/20 0.40
▸ KCNJ6 P48051 10/20 0.39
▸ KCNJ3 P48549 10/20 0.39
▸ PDE10A Q9Y233 1/20 0.39
▸ RET P07949 1/20 0.38
▸ KCNJ5 P48544 5/20 0.37
▸ IDO1 P14902 1/20 0.36
▸ MAT2A P31153 1/20 0.36
▸ PSMD14 O00487 1/20 0.35
▸ L3MBTL1 Q9Y468 1/20 0.35

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
SCHEMBL14401146 0.81 JAK2 (0.43) GAACYP3A4CYP2C19KCNJ6KCNJ3
SCHEMBL17580256 0.81 KDM4E (0.36) KDM4EKMT2AGAACYP3A4CYP2C19
SCHEMBL25793174 0.73 KCNJ6 (0.69) KCNJ6KCNJ3KCNJ5
SCHEMBL24007919 0.73 TMIGD3 (0.43) KDM4EKMT2AGAACYP3A4CYP2C19
SCHEMBL19091627 0.73 KDM4E (0.40) KDM4EKMT2ARETMAT2APSMD14
SCHEMBL17580560 0.72 MAP3K14 (0.41) RET
SCHEMBL18055557 0.71 KDM4E (0.38) KDM4EKMT2ARET
SCHEMBL6887721 0.71 MAP3K12 (0.40) KDM4EKMT2ARET
SCHEMBL19650841 0.70 KDM4E (0.39) KDM4EKMT2ARETMAT2A
SCHEMBL21178704 0.69 KDM4E (0.38) KDM4EKMT2ARET

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7279474-B2 Substituted pyrrolo[2,3-d]pyrimidines as antagonists of the corticotropin releasing factor (CRF) GLAXO GROUP LIMITED (GB) 2007-10-09 — — US disclosed
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