SCHEMBL18715948

SCHEMBL18715948

CC(Cc1ccc(Nc2cccc(CC(C)c3ccccc3)c2)cc1)c1ccccc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 5/20 0.44
▸ MEN1 O00255 1/20 0.44
▸ AR P10275 1/20 0.44
▸ MAPT P10636 1/20 0.44
▸ KMT2A Q03164 1/20 0.44
▸ NR3C2 P08235 1/20 0.44
▸ TSHR P16473 4/20 0.42
▸ HSD17B10 Q99714 4/20 0.42
▸ CYP3A4 P08684 4/20 0.42
▸ ALOX15 P16050 3/20 0.42
▸ ALOX12 P18054 3/20 0.42
▸ TDP1 Q9NUW8 2/20 0.42
▸ L3MBTL1 Q9Y468 2/20 0.42
▸ LMNA P02545 1/20 0.42
▸ THRB P10828 1/20 0.42
▸ RECQL P46063 1/20 0.42
▸ ATM Q13315 1/20 0.42
▸ NPSR1 Q6W5P4 1/20 0.42
▸ SIGMAR1 Q99720 3/20 0.41
▸ ESR1 P03372 1/20 0.41

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
SCHEMBL22636537 0.89 ESR1 (0.52) ALDH1A1TSHRHSD17B10CYP3A4ALOX15
SCHEMBL22636511 0.89 ESR1 (0.50) ALDH1A1NR3C2TSHRHSD17B10CYP3A4
SCHEMBL998287 0.89 ESR1 (0.50) ALDH1A1NR3C2TSHRHSD17B10CYP3A4
SCHEMBL998286 0.85 ESR1 (0.50) ALDH1A1TSHRHSD17B10CYP3A4ALOX15
SCHEMBL20782071 0.80 ALDH1A1 (0.54) ALDH1A1MEN1ARMAPTKMT2A
SCHEMBL25381540 0.80 TAAR1 (0.52) NR3C2SIGMAR1ESR1ESR2SLC6A2
SCHEMBL1704016 0.80 ESR1 (0.46) ALDH1A1MEN1KMT2ATSHRHSD17B10
SCHEMBL3684825 0.80 TAAR1 (0.50) NR3C2SIGMAR1ESR1ESR2SLC6A2
SCHEMBL9069704 0.78 ESR1 (0.61) SIGMAR1ESR1ESR2SLC6A2TAAR1
SCHEMBL8983689 0.78 TAAR1 (0.56) SIGMAR1ESR1ESR2SLC6A2TAAR1

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-10414901-B2 Stabilized rubbers ARLANXEO DEUTSCHLAND GMBH (DE) 2019-09-17 — — US disclosed
US-20170137607-A1 STABILIZED RUBBERS AQUASPERSIONS LTD (GB) 2017-05-18 — — US disclosed
US-20170096544-A1 BASIC STABILISATION SYSTEMS FOR EMULSION POLYMERISED RUBBER BASF SE (DE) 2017-04-06 — — US disclosed
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