SCHEMBL726207

SCHEMBL726207

Cc1cc(-c2c(F)c(F)c(-c3cc(C)c(-n4nnc5ccccc54)s3)c3nsnc23)sc1Br

nearest known ligand 0.36

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ SMN1; SMN2 Q16637 3/20 0.36
▸ TSHR P16473 3/20 0.36
▸ KMT2A Q03164 3/20 0.33
▸ ALDH1A1 P00352 3/20 0.33
▸ KDM4E B2RXH2 2/20 0.33
▸ LMNA P02545 3/20 0.32
▸ HSD17B10 Q99714 2/20 0.32
▸ HPGD P15428 2/20 0.32
▸ MAPT P10636 1/20 0.32
▸ ALOX15 P16050 1/20 0.32
▸ RAB9A P51151 1/20 0.30
▸ KCNMA1 Q12791 1/20 0.30
▸ MEN1 O00255 1/20 0.30

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
SCHEMBL14868190 0.78 — —
SCHEMBL21094220 0.65 — —
SCHEMBL20082353 0.64 — —
SCHEMBL28518251 0.63 MAPT (0.44) SMN1; SMN2TSHRKMT2AALDH1A1KDM4E
SCHEMBL18665537 0.63 KDM4E (0.32) KMT2AKDM4ELMNAMAPTMEN1
SCHEMBL21689581 0.62 KCNMA1 (0.48) SMN1; SMN2TSHRKMT2AALDH1A1KDM4E
SCHEMBL20193321 0.62 CASP3 (0.33) —
SCHEMBL842186 0.61 ESR2 (0.34) KMT2AMAPTMEN1
SCHEMBL20255779 0.61 SMN1; SMN2 (0.47) SMN1; SMN2TSHRKMT2AALDH1A1KDM4E
SCHEMBL24445607 0.61 ALDH1A1 (0.56) SMN1; SMN2TSHRKMT2AALDH1A1KDM4E

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
WO-2011156478-A2 POLYMERS WITH TUNABLE BAND GAPS FOR PHOTONIC AND ELECTRONIC APPLICATIONS THE UNIVERSITY OF NORTH CAROLINA AT CHAPEL HILL (US) 2011-12-15 — — WO disclosed
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