SCHEMBL11270504

SCHEMBL11270504

CCOC(=S)CCc1ccc(OC)cc1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
F2RL1 P55085 1/20 0.53
GLA P06280 1/20 0.53
KMT2A Q03164 1/20 0.53
LMNA P02545 3/20 0.47
KDM4E B2RXH2 1/20 0.47
ALOX5 P09917 1/20 0.47
CALM1 P0DP23 1/20 0.47
TAAR1 Q96RJ0 1/20 0.47
MAPT P10636 1/20 0.47
L3MBTL1 Q9Y468 1/20 0.47
ALDH1A1 P00352 3/20 0.46
POLB P06746 1/20 0.46
NFKB1 P19838 1/20 0.46
NFKB2 Q00653 1/20 0.46
RELA Q04206 1/20 0.46
FFAR1 O14842 1/20 0.46
PKM P14618 1/20 0.46
SLC5A1 P13866 1/20 0.45
SLC5A2 P31639 1/20 0.45
RXFP1 Q9HBX9 1/20 0.45

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
SCHEMBL12437151 0.82 ALDH1A1 (0.49) GLAKMT2ALMNAKDM4EMAPT
SCHEMBL27551498 0.82 F2RL1 (0.49) F2RL1LMNAKDM4EALOX5CALM1
SCHEMBL8430511 0.81 NPC1 (0.55) F2RL1KMT2AKDM4EMAPTL3MBTL1
SCHEMBL11272466 0.81 KMT2A (0.45) KMT2ALMNATAAR1MAPTALDH1A1
SCHEMBL27352286 0.80 L3MBTL1 (0.50) KMT2AALOX5MAPTL3MBTL1ALDH1A1
SCHEMBL490909 0.79 CYP4F2 (0.70) F2RL1GLAKMT2ALMNAALOX5
SCHEMBL498481 0.78 F2RL1 (0.59) F2RL1LMNAKDM4EALOX5CALM1
SCHEMBL28343165 0.77 F2RL1 (0.54) F2RL1LMNAKDM4EALOX5CALM1
SCHEMBL10995705 0.77 NAMPT (0.49) KMT2ALMNAALDH1A1POLB
SCHEMBL7060212 0.77 F2RL1 (0.58) F2RL1GLAKMT2ALMNAALOX5

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 8 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4325964-A SEDATIVES, MUSCLE RELAXANTS, HYPOTENSIVE AGENTS LABORATOIRE L. LAFON (FR) 1982-04-20 US disclosed
US-4225617-A PSYCHOTROPIC AGENTS LABORATOIRE L. LAFON (FR) 1980-09-30 US disclosed
US-4209524-A CENTRAL NERVOUS SYSTEM LABORATOIRE L. LAFON (FR) 1980-06-24 US disclosed
US-4209523-A TREATMENT OF THE CENTRAL NERVOUS SYSTEM LABORATOIRE L. LAFON (FR) 1980-06-24 US disclosed
US-4183951-A PSYCHOTROPIC AGENTS LABORATOIRE L. LAFON (FR) 1980-01-15 US disclosed
US-4152458-A CENTRAL NERVOUS SYSTEM, PSYCHOTROPIC AGENTS LABORATOIRE L. LAFON (FR) 1979-05-01 US disclosed
US-4151300-A CENTRAL NERVOUS SYSTEM, PSYCHOTROPIC LABORATOIRE L. LAFON (FR) 1979-04-24 US disclosed
US-4122186-A PSYCHOTROPIC AGENTS LABORATOIRE L. LAFON (FR) 1978-10-24 US disclosed