SCHEMBL17925445

SCHEMBL17925445

CN1CCN(C(=O)CCc2csc(NC(=O)Nc3ccccc3)n2)CC1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 4/20 0.53
▸ TP53 P04637 1/20 0.53
▸ MEN1 O00255 5/20 0.48
▸ KMT2A Q03164 5/20 0.48
▸ ALDH1A1 P00352 2/20 0.48
▸ MAPK1 P28482 2/20 0.48
▸ SMN1; SMN2 Q16637 2/20 0.48
▸ NPC1 O15118 1/20 0.48
▸ POLB P06746 1/20 0.48
▸ RAB9A P51151 1/20 0.48
▸ MAPT P10636 3/20 0.47
▸ ADORA3 P0DMS8 2/20 0.47
▸ HTT P42858 1/20 0.45
▸ ROCK1 Q13464 1/20 0.45
▸ KDM4E B2RXH2 1/20 0.44
▸ HSD11B1 P28845 2/20 0.44
▸ HSD17B1 P14061 1/20 0.44
▸ HSD17B2 P37059 1/20 0.44
▸ F2 P00734 1/20 0.43
▸ F10 P00742 1/20 0.43

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
SCHEMBL17925455 0.92 LMNA (0.53) LMNATP53MEN1KMT2AALDH1A1
SCHEMBL17935506 0.90 LMNA (0.50) LMNATP53MEN1KMT2AALDH1A1
SCHEMBL17925451 0.89 LMNA (0.53) LMNATP53MEN1KMT2AALDH1A1
SCHEMBL17925438 0.89 LMNA (0.49) LMNATP53MEN1KMT2AALDH1A1
SCHEMBL17925453 0.88 POLB (0.54) LMNATP53MEN1KMT2AALDH1A1
SCHEMBL17925436 0.88 LMNA (0.48) LMNATP53MEN1KMT2AALDH1A1
SCHEMBL17925432 0.88 RAB9A (0.52) LMNATP53MEN1KMT2AALDH1A1
SCHEMBL17925435 0.88 LMNA (0.50) LMNATP53MEN1KMT2AALDH1A1
SCHEMBL17925442 0.87 LMNA (0.48) LMNATP53MEN1KMT2AALDH1A1
SCHEMBL17925434 0.85 F13A1 (0.51) LMNATP53MEN1KMT2AALDH1A1

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 claimed
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