SCHEMBL27749161

SCHEMBL27749161

Nc1ccc(Cc2ccc(C(=O)c3ccccc3)cc2)cc1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PLA2G10 O15496 1/20 0.58
▸ PLA2G2A P14555 1/20 0.58
▸ ALDH1A1 P00352 2/20 0.54
▸ TDP1 Q9NUW8 2/20 0.54
▸ CYP3A4 P08684 1/20 0.54
▸ TSHR P16473 1/20 0.54
▸ LMNA P02545 2/20 0.53
▸ PBRM1 Q86U86 1/20 0.53
▸ SRD5A2 P31213 4/20 0.53
▸ KMT2A Q03164 3/20 0.51
▸ MEN1 O00255 2/20 0.51
▸ MAPT P10636 2/20 0.50
▸ GAA P10253 1/20 0.50
▸ MPO P05164 1/20 0.48
▸ RAB9A P51151 2/20 0.47
▸ NPC1 O15118 1/20 0.47
▸ MAOA P21397 2/20 0.47
▸ MAOB P27338 2/20 0.47
▸ ATM Q13315 1/20 0.47
▸ L3MBTL1 Q9Y468 1/20 0.47

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
SCHEMBL9719313 0.92 CYP3A4 (0.64) PLA2G10PLA2G2AALDH1A1TDP1CYP3A4
SCHEMBL9719377 0.92 CYP3A4 (0.64) PLA2G10PLA2G2AALDH1A1TDP1CYP3A4
SCHEMBL8094666 0.90 ALDH1A1 (0.67) PLA2G10PLA2G2AALDH1A1TDP1LMNA
SCHEMBL4004691 0.88 LMNA (0.67) PLA2G10PLA2G2AALDH1A1TDP1LMNA
SCHEMBL49952 0.88 ALDH1A1 (0.70) ALDH1A1TDP1LMNAPBRM1SRD5A2
SCHEMBL9719354 0.86 PBRM1 (0.66) PLA2G10PLA2G2AALDH1A1TDP1CYP3A4
SCHEMBL1247035 0.86 PLA2G10 (0.69) PLA2G10PLA2G2AALDH1A1TDP1TSHR
Ammonia Solution, Strong SCHEMBL28612928 0.86 ALDH1A1 (0.67) ALDH1A1TDP1LMNAPBRM1SRD5A2
Hydrochloric Acid SCHEMBL8746067 0.86 ALDH1A1 (0.67) ALDH1A1TDP1LMNAPBRM1SRD5A2
Bicarbonate SCHEMBL27627699 0.86 ALDH1A1 (0.67) ALDH1A1TDP1LMNAPBRM1SRD5A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-100513485-C Silicone rubber composition for electrode circuit protection, electrode circuit protection material, and electrical and electronic component SHINETSU CHEMICAL CO (JP) 2009-07-15 — — CN disclosed
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