SCHEMBL17935540

SCHEMBL17935540

CC(C)NC(=O)CCc1csc(NC(=O)Nc2ccccc2)n1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 3/20 0.57
▸ TP53 P04637 1/20 0.57
▸ MEN1 O00255 7/20 0.53
▸ KMT2A Q03164 7/20 0.53
▸ SMN1; SMN2 Q16637 3/20 0.53
▸ NPC1 O15118 3/20 0.53
▸ RAB9A P51151 3/20 0.53
▸ ALDH1A1 P00352 2/20 0.53
▸ MAPK1 P28482 2/20 0.53
▸ POLB P06746 1/20 0.53
▸ MAPT P10636 4/20 0.52
▸ ADORA3 P0DMS8 2/20 0.52
▸ HTT P42858 1/20 0.49
▸ ROCK1 Q13464 1/20 0.49
▸ ITGB1 P05556 2/20 0.48
▸ ITGA4 P13612 2/20 0.48
▸ CYP1A2 P05177 1/20 0.47
▸ CYP3A4 P08684 1/20 0.47
▸ CYP2D6 P10635 1/20 0.47
▸ CYP2C9 P11712 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
SCHEMBL17935541 0.88 LMNA (0.60) LMNATP53MEN1KMT2ASMN1; SMN2
SCHEMBL17925437 0.85 KMT2A (0.63) LMNATP53MEN1KMT2ASMN1; SMN2
SCHEMBL17925446 0.83 LMNA (0.54) LMNATP53MEN1KMT2ASMN1; SMN2
SCHEMBL17935513 0.82 LMNA (0.53) LMNATP53MEN1KMT2ASMN1; SMN2
SCHEMBL17925430 0.81 LMNA (0.55) LMNATP53MEN1KMT2ASMN1; SMN2
SCHEMBL17925450 0.81 LMNA (0.53) LMNATP53MEN1KMT2ASMN1; SMN2
SCHEMBL17935512 0.81 LMNA (0.79) LMNATP53MEN1KMT2ASMN1; SMN2
SCHEMBL10084544 0.80 LMNA (0.71) LMNATP53MEN1KMT2ASMN1; SMN2
SCHEMBL1514657 0.80 LMNA (0.67) LMNATP53MEN1KMT2ASMN1; SMN2
SCHEMBL17925439 0.79 LMNA (0.53) LMNATP53MEN1KMT2ASMN1; SMN2

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
WO-2016112513-A1 COMPOUNDS AND METHODS FOR INDUCING MESENCHYMAL STEM CELLS INTO CHONDROCYTES GUANGZHOU INSTITUTES OF BIOMEDICINE AND HEALTH, CHINESE ACADEMY OF SCIENCES (CN) 2016-07-21 — — WO disclosed
Send feedback