SCHEMBL9456876

SCHEMBL9456876

ClCc1ccc(-c2ccc(-c3ccc(CCl)cc3)cc2)cc1

nearest known ligand 0.47

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ HRH3 Q9Y5N1 9/20 0.47
▸ CA1 P00915 2/20 0.46
▸ CA2 P00918 2/20 0.46
▸ HRH4 Q9H3N8 2/20 0.40
▸ TAAR1 Q96RJ0 3/20 0.39
▸ MAOB P27338 1/20 0.39
▸ CYP2D6 P10635 1/20 0.36
▸ CYP2C19 P33261 1/20 0.36
▸ ABCC4 O15439 1/20 0.35
▸ LMNA P02545 1/20 0.35
▸ GAA P10253 1/20 0.35
▸ TSHR P16473 1/20 0.35
▸ PTGS1 P23219 1/20 0.35
▸ HTT P42858 1/20 0.35
▸ IDO1 P14902 1/20 0.35
▸ AGXT P21549 1/20 0.35
▸ FAAH O00519 1/20 0.34
▸ MGLL Q99685 1/20 0.34

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
SCHEMBL187751 1.00 HRH3 (0.47) HRH3CA1CA2HRH4TAAR1
Water SCHEMBL11480029 0.97 HRH3 (0.45) HRH3CA1CA2HRH4TAAR1
SCHEMBL22156858 0.91 HRH3 (0.41) HRH3CA1CA2HRH4TAAR1
SCHEMBL97582 0.89 CA1 (0.52) HRH3CA1CA2TAAR1TSHR
SCHEMBL1071609 0.88 TAAR1 (0.56) TAAR1ABCC4LMNAGAATSHR
SCHEMBL2069301 0.88 MAOB (0.54) CA1CA2TAAR1MAOBLMNA
SCHEMBL3599879 0.86 NPC1 (0.48) HRH3CA2TAAR1GAATSHR
SCHEMBL16253356 0.86 HRH3 (0.74) HRH3TAAR1MAOB
SCHEMBL1725688 0.86 MAOB (0.52) CA1CA2TAAR1MAOBIDO1
SCHEMBL9023183 0.86 IDO1 (0.46) HRH3TAAR1LMNAIDO1AGXT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5229481-A High-molecular weight, silicon-containing polymers and methods for the preparation and use thereof THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 1993-07-20 — — US disclosed
US-4248976-A COMPRISING A PHOSPHORUS COMPOUND AND AN AROMATIC COMPOUND CIBA-GEIGY AG (CH) 1981-02-03 — — US disclosed
US-4172858-A Flame-resistant polymer compositions CIBA-GEIGY AG (CH) 1979-10-30 — — US disclosed
US-4163731-A HYDRAULIC FLUIDS CIBA-GEIGY AG (CH) 1979-08-07 — — US disclosed
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