SCHEMBL10397352

SCHEMBL10397352

CCOC(=O)c1[nH]c(-c2ccc(F)cc2)cc1-c1ccc(F)cc1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 3/20 0.61
GCGR P47871 2/20 0.61
MEN1 O00255 3/20 0.50
KMT2A Q03164 3/20 0.50
CYP1A2 P05177 1/20 0.50
CYP3A4 P08684 1/20 0.50
CYP2C19 P33261 1/20 0.50
PRKCZ Q05513 1/20 0.49
NPC1 O15118 2/20 0.47
RAB9A P51151 2/20 0.47
KDM4E B2RXH2 2/20 0.46
MAPT P10636 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
GSK3B P49841 1/20 0.46
HPGD P15428 2/20 0.45
ALDH1A1 P00352 1/20 0.45
GAA P10253 1/20 0.45
TSHR P16473 1/20 0.45
MAPK1 P28482 1/20 0.45
NPSR1 Q6W5P4 1/20 0.45

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
SCHEMBL3344995 0.86 TUBB4A (0.53) MAPK14GCGRMEN1KMT2ACYP1A2
SCHEMBL5774019 0.85 MAPT (0.54) MAPK14GCGRMEN1KMT2ACYP1A2
SCHEMBL12971261 0.83 ALDH1A1 (0.50) MAPK14GCGRMEN1KMT2ACYP1A2
SCHEMBL1567586 0.81 PTGER2 (0.53) MEN1KMT2ANPC1RAB9AKDM4E
SCHEMBL18529243 0.80 ALDH1A1 (0.43) MAPK14GCGRMEN1KMT2ANPC1
SCHEMBL1156279 0.79 KMT2A (0.67) MAPK14GCGRMEN1KMT2ACYP1A2
SCHEMBL9015200 0.78 SLC6A2 (0.49) MAPK14GCGRCYP1A2CYP2C19SMN1; SMN2
SCHEMBL16828410 0.77 PRKCZ (0.51) MAPK14GCGRMEN1KMT2APRKCZ
SCHEMBL18342044 0.77 MEN1 (0.55) MAPK14GCGRMEN1KMT2ACYP1A2
SCHEMBL18529232 0.76 HDAC3 (0.47) MEN1KMT2ANPC1RAB9AKDM4E

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-4937255-A Disubstituted pyrroles BAYER AKTIENGESELLSCHAFT (DE) 1990-06-26 US disclosed
EP-0334147-A1 Disubstituted pyrroles BAYER AG (DE) 1989-09-27 EP disclosed