SCHEMBL7955633

SCHEMBL7955633

CCOC(=O)C1CSCN1C(=O)c1cccnc1Cl

nearest known ligand 0.59

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
CYP2C19 P33261 2/20 0.59
POLB P06746 3/20 0.43
LMNA P02545 3/20 0.41
SMN1; SMN2 Q16637 2/20 0.41
ALDH1A1 P00352 1/20 0.41
NPSR1 Q6W5P4 1/20 0.40
HSD17B10 Q99714 1/20 0.40
P2RX7 Q99572 2/20 0.40
NR1D1 P20393 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.38
RAB9A P51151 1/20 0.38
HSD11B1 P28845 1/20 0.38
CYP1A2 P05177 1/20 0.37
CYP2C9 P11712 1/20 0.37

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
SCHEMBL7946469 0.90 CYP2C19 (0.61) CYP2C19POLBLMNASMN1; SMN2ALDH1A1
SCHEMBL7955525 0.83 SMN1; SMN2 (0.48) CYP2C19POLBLMNASMN1; SMN2ALDH1A1
SCHEMBL7954837 0.80 CYP2C19 (0.65) CYP2C19POLBSMN1; SMN2ALDH1A1HSD17B10
SCHEMBL7953661 0.77 CYP2C19 (0.45) CYP2C19POLBALDH1A1NPSR1NR1D1
SCHEMBL7953694 0.76 SMN1; SMN2 (0.48) CYP2C19POLBLMNASMN1; SMN2ALDH1A1
SCHEMBL9724034 0.72 KMT2A (0.50) POLBSMN1; SMN2ALDH1A1HSD17B10NR1D1
SCHEMBL20366905 0.70 NR1D1 (0.46) CYP2C19ALDH1A1NPSR1HSD17B10NR1D1
SCHEMBL49913 0.70 POLB (0.66) CYP2C19POLBLMNASMN1; SMN2ALDH1A1
SCHEMBL13469115 0.70 MEN1 (0.45) POLBSMN1; SMN2ALDH1A1NPSR1HSD17B10
SCHEMBL7051453 0.69 ALDH1A1 (0.41) POLBSMN1; SMN2ALDH1A1NPSR1HSD17B10

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
US-6194426-B1 CONTROLLING TUMOR NECROSIS FACTOR RHONA-POULENC RORER S.A. (FR) 2001-02-27 US disclosed