SCHEMBL5022620

SCHEMBL5022620

O=C(c1ccc(Br)cc1)c1cc(Cl)ccc1Cl

nearest known ligand 0.53

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.53
TP53 P04637 3/20 0.53
SRD5A2 P31213 2/20 0.51
CCR9 P51686 1/20 0.48
MAPT P10636 4/20 0.47
RAB9A P51151 1/20 0.47
AKR1C3 P42330 1/20 0.47
LMNA P02545 1/20 0.46
SLC10A6 Q3KNW5 1/20 0.45
NPC1 O15118 1/20 0.45
MAPK1 P28482 1/20 0.45
HTT P42858 1/20 0.45
ERCC5 P28715 1/20 0.44
FEN1 P39748 1/20 0.44
RECQL P46063 1/20 0.44

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
SCHEMBL7466437 0.89 ALDH1A1 (0.61) ALDH1A1TP53SRD5A2MAPTRAB9A
SCHEMBL7871642 0.86 SRD5A2 (0.70) ALDH1A1TP53SRD5A2MAPTRAB9A
SCHEMBL14419538 0.84 HPGD (0.56) ALDH1A1TP53SRD5A2CCR9MAPT
SCHEMBL612249 0.84 MAPK1 (0.62) ALDH1A1TP53SRD5A2MAPTRAB9A
SCHEMBL4711796 0.83 AKR1C3 (0.62) ALDH1A1TP53SRD5A2CCR9AKR1C3
SCHEMBL29362984 0.83 MAPT (0.50) TP53SRD5A2CCR9MAPTRAB9A
SCHEMBL2473605 0.83 MAPT (0.67) ALDH1A1CCR9MAPTAKR1C3LMNA
SCHEMBL13309942 0.82 CNR2 (0.60) ALDH1A1TP53SRD5A2MAPTLMNA
SCHEMBL809876 0.82 ALDH1A1 (0.53) ALDH1A1TP53SRD5A2MAPTRAB9A
SCHEMBL13538924 0.82 ALDH1A1 (0.53) ALDH1A1TP53SRD5A2MAPTRAB9A

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-20080241628-A1 MEMBRANE-ELECTRODE ASSEMBLY FOR SOLID POLYMER ELECTROLYTE FUEL CELL HONDA MOTOR CO. LTD. (JP) 2008-10-02 US disclosed
EP-0600318-A1 Asymmetric, halogenated benzophenones and process for their preparation HOECHST AKTIENGESELLSCHAFT (DE) 1994-06-08 EP disclosed