SCHEMBL6204601

SCHEMBL6204601

COC([O])Cc1ccc(C)cc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PKM P14618 1/20 0.41
ATM Q13315 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
AGXT P21549 2/20 0.40
IDO1 P14902 1/20 0.39
PPARG P37231 2/20 0.39
PPARA Q07869 2/20 0.39
CA1 P00915 1/20 0.38
CA2 P00918 1/20 0.38
CA9 Q16790 1/20 0.38
HPGD P15428 1/20 0.38
LDHA P00338 1/20 0.37
CYP1A2 P05177 1/20 0.37
CYP2A6 P11509 1/20 0.37
TAAR1 Q96RJ0 1/20 0.37
ACACB O00763 1/20 0.37
SMN1; SMN2 Q16637 2/20 0.36
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36
ACHE P22303 1/20 0.36

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
SCHEMBL6205901 0.81 TRPA1 (0.46) AGXTIDO1PPARGPPARACA9
SCHEMBL6204426 0.81 LDHA (0.58) AGXTIDO1PPARGPPARACA1
SCHEMBL1357677 0.80 TAAR1 (0.46) PKMATMPPARGPPARACYP1A2
SCHEMBL9484637 0.79 AGXT (0.44) PKMATML3MBTL1AGXTIDO1
SCHEMBL6204802 0.78 MEN1 (0.40) L3MBTL1LDHASMN1; SMN2MEN1KMT2A
SCHEMBL6205345 0.76 IDO1 (0.47) IDO1TAAR1ACHE
SCHEMBL6551869 0.76 AGXT (0.41) PKMATML3MBTL1AGXTIDO1
SCHEMBL7643271 0.75 IDO1 (0.44) AGXTIDO1PPARGPPARACA1
SCHEMBL6204603 0.74 AGXT (0.40) PKMATML3MBTL1AGXTIDO1
SCHEMBL6832904 0.73 IDO1 (0.42) L3MBTL1AGXTIDO1PPARGPPARA

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-1668601-A N-substituted tricyclic 3-aminopyrazoles as PDFG receptor inhibitors JANSSEN PHARMACEUTICA NV (BE) 2005-09-14 CN disclosed
EP-1506175-A1 N-SUBSTITUTED TRICYCLIC 3-AMINOPYRAZOLES AS PDGF RECEPTOR INHIBITORS JANSSEN PHARMACEUTICA N.V. (BE) 2005-02-16 EP disclosed
WO-2003097609-A1 N-SUBSTITUTED TRICYCLIC 3-AMINOPYRAZOLES AS PDFG RECEPTOR INHIBITORS JANSSEN PHARMACEUTICA N.V. (BE) 2003-11-27 WO disclosed
US-RE29834-E PREPARED FROM 4-SULFONYL-1,8-NAPHTHOLACTAMS BAYER AKTIENGESELLSCHAFT (DE) 1978-11-14 US disclosed
US-3959310-A BENZINDOLE BAYER AKTIENGESELLSCHAFT (DT) 1976-05-25 US disclosed