SCHEMBL8077926

SCHEMBL8077926

C=CCCCc1ccc(OCCCC)cc1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.51
LMNA P02545 2/20 0.51
SMN1; SMN2 Q16637 2/20 0.51
MEN1 O00255 1/20 0.51
USP2 O75604 1/20 0.51
CYP3A4 P08684 1/20 0.51
MAPK1 P28482 1/20 0.51
CASP1 P29466 1/20 0.51
KMT2A Q03164 1/20 0.51
SLCO1B3 Q9NPD5 1/20 0.51
SLCO1B1 Q9Y6L6 1/20 0.51
THRB P10828 1/20 0.50
L3MBTL1 Q9Y468 2/20 0.49
HRH3 Q9Y5N1 1/20 0.45
LTA4H P09960 1/20 0.44
KDM4E B2RXH2 1/20 0.44
CYP1A2 P05177 1/20 0.44
CYP2D6 P10635 1/20 0.44
PDE4A P27815 1/20 0.44
HIF1A Q16665 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
SCHEMBL8078002 0.95 ALDH1A1 (0.54) ALDH1A1LMNASMN1; SMN2MEN1USP2
SCHEMBL8062365 0.95 L3MBTL1 (0.51) ALDH1A1LMNASMN1; SMN2MEN1USP2
SCHEMBL8072706 0.93 ALDH1A1 (0.56) ALDH1A1LMNASMN1; SMN2MEN1USP2
SCHEMBL8062707 0.93 ALDH1A1 (0.56) ALDH1A1LMNASMN1; SMN2MEN1USP2
SCHEMBL8062725 0.93 ALDH1A1 (0.56) ALDH1A1LMNASMN1; SMN2MEN1USP2
SCHEMBL8072545 0.93 ALDH1A1 (0.56) ALDH1A1LMNASMN1; SMN2MEN1USP2
SCHEMBL8072074 0.91 ALDH1A1 (0.49) ALDH1A1LMNASMN1; SMN2MEN1USP2
SCHEMBL8072896 0.90 LMNA (0.50) ALDH1A1LMNASMN1; SMN2MEN1USP2
SCHEMBL8076261 0.89 MEN1 (0.51) ALDH1A1LMNASMN1; SMN2MEN1USP2
SCHEMBL8071480 0.89 MEN1 (0.51) ALDH1A1LMNASMN1; SMN2MEN1USP2

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6063940-A Process for preparing 1-bromoalkylbenzene derivatives and intermediates thereof SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2000-05-16 US disclosed
US-5637736-A Process for preparing 1-bromoalkylbenzene derivatives and intermediates thereof SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1997-06-10 US disclosed
EP-0637580-A1 Process for preparing 1-bromoalkylbenzene derivatives and intermediates thereof SUMITOMO CHEMICAL COMPANY LIMITED (JP) 1995-02-08 EP disclosed