SCHEMBL7766977

SCHEMBL7766977

COP(=O)(OC)C(Br)Cc1cc(-c2ncc(C(F)(F)F)cc2Cl)ccc1Cl

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 5/20 0.41
ALDH1A1 P00352 5/20 0.41
KDM4E B2RXH2 2/20 0.41
POLB P06746 1/20 0.41
NPC1 O15118 5/20 0.40
RAB9A P51151 5/20 0.40
MAPK1 P28482 2/20 0.40
MAPT P10636 1/20 0.40
HTT P42858 1/20 0.40
RXFP1 Q9HBX9 1/20 0.38
PKM P14618 1/20 0.38
MEN1 O00255 3/20 0.37
KMT2A Q03164 3/20 0.37
STAT3 P40763 1/20 0.37
STAT1 P42224 1/20 0.37
CASP3 P42574 1/20 0.37
SENP8 Q96LD8 1/20 0.37
SENP7 Q9BQF6 1/20 0.37
SENP6 Q9GZR1 1/20 0.37
L3MBTL1 Q9Y468 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
SCHEMBL8146716 0.86 SMN1; SMN2 (0.43) SMN1; SMN2ALDH1A1KDM4EPOLBNPC1
SCHEMBL6173817 0.81 MAPK1 (0.52) SMN1; SMN2ALDH1A1KDM4EPOLBNPC1
SCHEMBL6176640 0.80 ALDH1A1 (0.50) SMN1; SMN2ALDH1A1KDM4EPOLBNPC1
SCHEMBL7766984 0.78 ALDH1A1 (0.38) SMN1; SMN2ALDH1A1KDM4EPOLBNPC1
SCHEMBL6175885 0.76 ALDH1A1 (0.54) SMN1; SMN2ALDH1A1KDM4EPOLBNPC1
SCHEMBL7762329 0.76 ALDH1A1 (0.43) SMN1; SMN2ALDH1A1KDM4EPOLBNPC1
SCHEMBL24485258 0.74 ALDH1A1 (0.54) SMN1; SMN2ALDH1A1KDM4EPOLBNPC1
SCHEMBL8665917 0.73 ALDH1A1 (0.50) SMN1; SMN2ALDH1A1KDM4EPOLBNPC1
SCHEMBL7762286 0.73 ALDH1A1 (0.40) SMN1; SMN2ALDH1A1KDM4EPOLBNPC1
SCHEMBL6176911 0.71 ALDH1A1 (0.57) SMN1; SMN2ALDH1A1KDM4EPOLBNPC1

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
EP-0880531-B1 SUBSTITUTED 2-PHENYLPYRIDINES BASF AG (DE) 2001-06-20 EP disclosed