SCHEMBL8705485

SCHEMBL8705485

CCc1cc(NC(=O)Oc2ccccc2)cnc1C

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ RAB9A P51151 1/20 0.53
▸ FAAH O00519 7/20 0.50
▸ ALDH1A1 P00352 7/20 0.50
▸ MAPT P10636 4/20 0.50
▸ CYP1A2 P05177 1/20 0.49
▸ PORCN Q9H237 1/20 0.47
▸ MEN1 O00255 3/20 0.47
▸ KMT2A Q03164 3/20 0.47
▸ THRB P10828 2/20 0.47
▸ HPGD P15428 1/20 0.47
▸ KDM4E B2RXH2 1/20 0.47
▸ GFER P55789 1/20 0.47
▸ TDP1 Q9NUW8 1/20 0.47
▸ GAA P10253 2/20 0.47
▸ HTT P42858 1/20 0.47
▸ SMN1; SMN2 Q16637 1/20 0.47
▸ LMNA P02545 1/20 0.46
▸ TP53 P04637 1/20 0.46
▸ RAD51 Q06609 1/20 0.46
▸ POLB P06746 1/20 0.45

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
SCHEMBL29739561 1.00 RAB9A (0.53) RAB9AFAAHALDH1A1MAPTCYP1A2
SCHEMBL29739567 0.83 RAB9A (0.52) RAB9AFAAHALDH1A1MAPTCYP1A2
SCHEMBL23240248 0.83 POLB (0.59) FAAHALDH1A1MAPTCYP1A2PORCN
SCHEMBL29716375 0.83 POLB (0.59) FAAHALDH1A1MAPTCYP1A2PORCN
SCHEMBL30933206 0.83 ALDH1A1 (0.59) FAAHALDH1A1MAPTCYP1A2PORCN
SCHEMBL29739583 0.82 POLB (0.57) FAAHALDH1A1MAPTCYP1A2PORCN
SCHEMBL24757867 0.79 ALDH1A1 (0.59) RAB9AFAAHALDH1A1MAPTCYP1A2
SCHEMBL24578585 0.79 ALDH1A1 (0.47) RAB9AFAAHALDH1A1MAPTCYP1A2
SCHEMBL29759632 0.79 ALDH1A1 (0.47) RAB9AFAAHALDH1A1MAPTCYP1A2
SCHEMBL29739440 0.78 ALDH1A1 (0.46) FAAHALDH1A1MAPTCYP1A2PORCN

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
US-5780472-A ANTITUMOR AGENTS SAMJIN PHARMACEUTICAZL CO., LTD. (KR) 1998-07-14 — — US disclosed
WO-1996021648-A1 NEW PIPERAZINE DERIVATIVES AND METHODS FOR THE PREPARATION THEREOF AND COMPOSITIONS CONTAINING THE SAME SAMJIN PHARMACEUTICAL CO., LTD. (KR) 1996-07-18 — — WO disclosed
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