SCHEMBL4580149

SCHEMBL4580149

Cc1ccccc1-c1ccc2ccccc2c1-c1ccccc1C

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ DNMT1 P26358 1/20 0.53
▸ ALDH1A1 P00352 4/20 0.50
▸ CYP2A6 P11509 4/20 0.50
▸ TSHR P16473 4/20 0.47
▸ CYP1A2 P05177 3/20 0.47
▸ HSD17B10 Q99714 3/20 0.44
▸ HPGD P15428 2/20 0.44
▸ MAPT P10636 2/20 0.42
▸ RAB9A P51151 2/20 0.42
▸ MEN1 O00255 1/20 0.42
▸ KMT2A Q03164 1/20 0.42
▸ SMN1; SMN2 Q16637 1/20 0.42
▸ TDP1 Q9NUW8 1/20 0.42
▸ BRD4 O60885 1/20 0.41
▸ HPRT1 P00492 1/20 0.39
▸ HSD11B1 P28845 1/20 0.39
▸ ADORA2A P29274 1/20 0.39
▸ CYP3A4 P08684 1/20 0.38
▸ MAPK1 P28482 1/20 0.38
▸ CASP1 P29466 1/20 0.38

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
SCHEMBL29177671 0.91 HPRT1 (0.50) DNMT1ALDH1A1CYP2A6TSHRCYP1A2
SCHEMBL2557210 0.86 CYP2A6 (0.54) DNMT1ALDH1A1CYP2A6TSHRCYP1A2
SCHEMBL7084153 0.83 CYP1A2 (0.44) DNMT1ALDH1A1CYP2A6TSHRCYP1A2
SCHEMBL16062615 0.82 TSHR (0.59) DNMT1ALDH1A1CYP2A6TSHRCYP1A2
SCHEMBL18132854 0.81 CYP2A6 (0.47) DNMT1ALDH1A1CYP2A6TSHRCYP1A2
SCHEMBL22812540 0.81 ALDH1A1 (0.47) DNMT1ALDH1A1CYP2A6TSHRCYP1A2
SCHEMBL18685785 0.81 NSD2 (0.54) DNMT1ALDH1A1CYP2A6TSHRCYP1A2
SCHEMBL31045609 0.81 DNMT1 (0.69) DNMT1ALDH1A1CYP2A6TSHRCYP1A2
SCHEMBL5047700 0.81 DNMT1 (0.69) DNMT1ALDH1A1CYP2A6TSHRCYP1A2
SCHEMBL6745701 0.80 ALDH1A1 (0.45) DNMT1ALDH1A1CYP2A6HSD17B10MAPT

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
EP-1943691-A2 N-TYPE SEMICONDUCTOR MATERIALS FOR THIN FILM TRANSISTORS EASTMAN KODAK COMPANY (US) 2008-07-16 — — EP claimed
WO-2007053303-A2 N-TYPE SEMICONDUCTOR MATERIALS FOR THIN FILM TRANSISTORS EASTMAN KODAK COMPANY (US) 2007-05-10 — — WO claimed
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