SCHEMBL17925438

SCHEMBL17925438

O=C(Nc1ccccc1)Nc1nc(CCC(=O)N2CCN(C(=O)c3ccccc3)CC2)cs1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 4/20 0.49
▸ TP53 P04637 1/20 0.49
▸ MAPT P10636 3/20 0.46
▸ ADORA3 P0DMS8 2/20 0.46
▸ MEN1 O00255 5/20 0.46
▸ KMT2A Q03164 5/20 0.46
▸ ALDH1A1 P00352 3/20 0.45
▸ MAPK1 P28482 2/20 0.45
▸ SMN1; SMN2 Q16637 2/20 0.45
▸ NPC1 O15118 1/20 0.45
▸ POLB P06746 1/20 0.45
▸ RAB9A P51151 1/20 0.45
▸ ROCK1 Q13464 1/20 0.44
▸ BLM P54132 1/20 0.43
▸ HTT P42858 1/20 0.42
▸ ALOX15 P16050 1/20 0.42
▸ TSHR P16473 1/20 0.42
▸ HSD17B10 Q99714 1/20 0.42
▸ IRAK4 Q9NWZ3 1/20 0.41
▸ KDM4E B2RXH2 1/20 0.41

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 0.89 LMNA (0.53) LMNATP53MAPTADORA3MEN1
SCHEMBL17935506 0.89 LMNA (0.50) LMNATP53MAPTADORA3MEN1
SCHEMBL17925445 0.89 LMNA (0.53) LMNATP53MAPTADORA3MEN1
SCHEMBL17925451 0.89 LMNA (0.53) LMNATP53MAPTADORA3MEN1
SCHEMBL17925436 0.87 LMNA (0.48) LMNATP53MAPTADORA3MEN1
SCHEMBL17925435 0.87 LMNA (0.50) LMNATP53MAPTADORA3MEN1
SCHEMBL17925432 0.87 RAB9A (0.52) LMNATP53MAPTADORA3MEN1
SCHEMBL17925442 0.86 LMNA (0.48) LMNATP53MAPTADORA3MEN1
SCHEMBL17925453 0.85 POLB (0.54) LMNATP53MAPTADORA3MEN1
SCHEMBL17925434 0.84 F13A1 (0.51) LMNATP53MAPTMEN1KMT2A

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
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
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
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