SCHEMBL18331409

SCHEMBL18331409

Cc1cc2cc(C(=O)/C(C#N)=C/N(C)C)[nH]c2cc1NC(=O)OC(C)(C)C

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 4/20 0.37
▸ ALDH1A1 P00352 4/20 0.37
▸ KMT2A Q03164 2/20 0.37
▸ KDM4E B2RXH2 1/20 0.37
▸ LMNA P02545 1/20 0.37
▸ TNNI3 P19429 1/20 0.37
▸ CRHBP P24387 1/20 0.37
▸ TNNT2 P45379 1/20 0.37
▸ KLK7 P49862 1/20 0.37
▸ TNNC1 P63316 1/20 0.37
▸ CRHR2 Q13324 1/20 0.37
▸ HPGD P15428 3/20 0.36
▸ NPSR1 Q6W5P4 2/20 0.35
▸ RECQL P46063 1/20 0.35
▸ RAB9A P51151 3/20 0.33
▸ LCK P06239 1/20 0.33
▸ L3MBTL1 Q9Y468 1/20 0.33
▸ LEF1 Q9UJU2 1/20 0.33
▸ MEN1 O00255 1/20 0.32
▸ CYP2C9 P11712 1/20 0.32

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
SCHEMBL20084815 0.90 RXFP1 (0.35) MAPTALDH1A1KMT2AKDM4ELMNA
SCHEMBL18332241 0.84 ALDH1A1 (0.39) MAPTALDH1A1KMT2AKDM4ELMNA
SCHEMBL20084014 0.82 ALDH1A1 (0.38) MAPTALDH1A1KMT2AKDM4ELMNA
SCHEMBL20085303 0.81 ALDH1A1 (0.38) MAPTALDH1A1KMT2AKDM4ELMNA
SCHEMBL20084085 0.80 HPGD (0.37) MAPTALDH1A1KMT2AKDM4ELMNA
SCHEMBL18331949 0.80 ALDH1A1 (0.37) MAPTALDH1A1KMT2AKDM4ELMNA
SCHEMBL18331951 0.79 ALDH1A1 (0.36) MAPTALDH1A1KMT2AKDM4ELMNA
SCHEMBL20084189 0.79 ALDH1A1 (0.36) MAPTALDH1A1KMT2AKDM4ELMNA
SCHEMBL20084819 0.79 RXFP1 (0.35) MAPTALDH1A1KMT2AKDM4ELMNA
SCHEMBL20084762 0.78 HPGD (0.35) MAPTALDH1A1KMT2ALMNAHPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3312172-B1 AMINOPYRAZOLE DERIVATIVES USEFUL AS SRC KINASE INHIBITORS CHUGAI PHARMACEUTICAL CO LTD (JP) 2020-05-06 — — EP disclosed
EP-3312172-A1 AMINOPYRAZOLE DERIVATIVES Chugai Seiyaku Kabushiki Kaisha (JP) 2018-04-25 — — EP disclosed
WO-2016204261-A1 AMINOPYRAZOLE DERIVATIVES 中外製薬株式会社 2016-12-22 — — WO disclosed
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