SCHEMBL8076244

SCHEMBL8076244

CCCOc1ccc(CCCCBr)cc1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 3/20 0.54
▸ L3MBTL1 Q9Y468 2/20 0.54
▸ SMN1; SMN2 Q16637 2/20 0.53
▸ MEN1 O00255 1/20 0.53
▸ USP2 O75604 1/20 0.53
▸ ALDH1A1 P00352 1/20 0.53
▸ CYP3A4 P08684 1/20 0.53
▸ MAPK1 P28482 1/20 0.53
▸ CASP1 P29466 1/20 0.53
▸ KMT2A Q03164 1/20 0.53
▸ SLCO1B3 Q9NPD5 1/20 0.53
▸ SLCO1B1 Q9Y6L6 1/20 0.53
▸ HRH3 Q9Y5N1 1/20 0.46
▸ ACACB O00763 1/20 0.44
▸ NPC1 O15118 1/20 0.44
▸ MAPT P10636 1/20 0.44
▸ NFKB1 P19838 1/20 0.44
▸ RAB9A P51151 1/20 0.44
▸ NFKB2 Q00653 1/20 0.44
▸ RELA Q04206 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
SCHEMBL8077727 0.98 LMNA (0.55) LMNAL3MBTL1SMN1; SMN2MEN1USP2
SCHEMBL8070756 0.98 LMNA (0.55) LMNAL3MBTL1SMN1; SMN2MEN1USP2
SCHEMBL8071194 0.98 LMNA (0.55) LMNAL3MBTL1SMN1; SMN2MEN1USP2
SCHEMBL8077691 0.98 LMNA (0.55) LMNAL3MBTL1SMN1; SMN2MEN1USP2
SCHEMBL8062362 0.98 LMNA (0.55) LMNAL3MBTL1SMN1; SMN2MEN1USP2
SCHEMBL8077772 0.95 LMNA (0.56) LMNAL3MBTL1SMN1; SMN2MEN1USP2
SCHEMBL8078024 0.95 LMNA (0.58) LMNAL3MBTL1SMN1; SMN2MEN1USP2
SCHEMBL8076372 0.93 MEN1 (0.60) LMNASMN1; SMN2MEN1USP2ALDH1A1
SCHEMBL8076106 0.93 MEN1 (0.60) LMNASMN1; SMN2MEN1USP2ALDH1A1
SCHEMBL8072244 0.93 MEN1 (0.60) LMNASMN1; SMN2MEN1USP2ALDH1A1

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
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