SCHEMBL27348634

SCHEMBL27348634

CCCS(c1ccccc1)(c1ccccc1)c1c2ccccc2cc2ccccc12

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 3/20 0.38
▸ KMT2A Q03164 3/20 0.38
▸ HTR2A P28223 1/20 0.36
▸ L3MBTL1 Q9Y468 1/20 0.36
▸ RAB9A P51151 1/20 0.36
▸ ATM Q13315 1/20 0.36
▸ ALDH1A1 P00352 3/20 0.35
▸ KDM4E B2RXH2 2/20 0.35
▸ CYP1A2 P05177 2/20 0.35
▸ HPGD P15428 2/20 0.35
▸ GLA P06280 1/20 0.35
▸ CYP2C19 P33261 1/20 0.35
▸ HSD17B10 Q99714 1/20 0.35
▸ PSIP1 O75475 1/20 0.34
▸ TDP1 Q9NUW8 2/20 0.34
▸ APAF1 O14727 1/20 0.34
▸ CASP3 P42574 1/20 0.34
▸ CASP6 P55212 1/20 0.34
▸ SENP8 Q96LD8 1/20 0.34
▸ SENP7 Q9BQF6 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
SCHEMBL20904616 0.77 PSIP1 (0.48) L3MBTL1ALDH1A1GLAHSD17B10PSIP1
SCHEMBL14559209 0.66 ALDH1A1 (0.44) MEN1KMT2AHTR2AL3MBTL1ALDH1A1
SCHEMBL15856771 0.65 ALDH1A1 (0.45) MEN1KMT2AHTR2AL3MBTL1ALDH1A1
SCHEMBL2839087 0.65 TDP1 (0.47) ALDH1A1PSIP1TDP1
SCHEMBL7915225 0.63 ALDH1A1 (0.61) MEN1KMT2AHTR2AL3MBTL1RAB9A
Butane SCHEMBL241215 0.63 PTPN22 (0.46) MEN1KMT2AHTR2AL3MBTL1ALDH1A1
SCHEMBL1613222 0.63 NR1I2 (0.47) MEN1KMT2AHTR2AL3MBTL1ALDH1A1
SCHEMBL2545824 0.63 MAPT (0.42) MEN1KMT2AHTR2AL3MBTL1RAB9A
SCHEMBL1610694 0.63 NR1I2 (0.44) MEN1KMT2AHTR2AL3MBTL1RAB9A
SCHEMBL2810003 0.63 TSHR (0.53) MEN1KMT2AHTR2AL3MBTL1ALDH1A1

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-1055825-A The photosensitive static mother matrix of positivity DU PONT (US) 1991-10-30 — — CN claimed
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