SCHEMBL9484288

SCHEMBL9484288

CC(Oc1ccc(CCNS(=O)(=O)c2ccc(Cl)cc2)cc1)N1CCCCC1

nearest known ligand 0.59

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
LSS P48449 1/20 0.59
ALDH1A1 P00352 6/20 0.53
HTT P42858 2/20 0.53
LMNA P02545 2/20 0.53
MEN1 O00255 2/20 0.53
KMT2A Q03164 2/20 0.53
SMN1; SMN2 Q16637 1/20 0.52
TBXA2R P21731 1/20 0.50
PPARG P37231 3/20 0.49
TP53 P04637 1/20 0.49
MAPT P10636 1/20 0.48
SGMS1 Q86VZ5 2/20 0.47
POLB P06746 2/20 0.47
USP2 O75604 1/20 0.47
PRMT1 Q99873 1/20 0.46

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
SCHEMBL9493082 0.82 MEN1 (0.64) LSSALDH1A1HTTLMNAMEN1
SCHEMBL9130927 0.79 LSS (0.90) LSSALDH1A1HTTLMNAMEN1
SCHEMBL9483898 0.79 MEN1 (0.56) LSSALDH1A1HTTLMNAMEN1
SCHEMBL7502501 0.78 LTA4H (0.50) ALDH1A1LMNAKMT2AMAPT
SCHEMBL9131391 0.78 LSS (0.65) LSSALDH1A1HTTLMNAMEN1
SCHEMBL6731066 0.78 SIGMAR1 (0.43) ALDH1A1LMNAKMT2ASMN1; SMN2MAPT
SCHEMBL9483947 0.78 MEN1 (0.59) ALDH1A1HTTLMNAMEN1KMT2A
SCHEMBL9129519 0.78 LSS (0.76) LSSALDH1A1HTTLMNAMEN1
SCHEMBL9172903 0.77 LSS (0.64) LSS
SCHEMBL10589292 0.77 ALDH1A1 (0.86) ALDH1A1MEN1KMT2ASMN1; SMN2TBXA2R

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
EP-0564499-A1 NOVEL AMINES, PROCESS FOR PRODUCING THEM AND MEDICAMENTS CONTAINING SAID COMPOUNDS. BOEHRINGER MANNHEIM GMBH (DE) 1993-10-13 EP disclosed