SCHEMBL9024874

SCHEMBL9024874

Fc1ccccc1Cc1cccs1

nearest known ligand 0.55

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
HPGD P15428 5/20 0.54
SMN1; SMN2 Q16637 2/20 0.54
ABL1 P00519 1/20 0.47
TAAR1 Q96RJ0 3/20 0.45
DRD4 P21917 1/20 0.44
DRD3 P35462 1/20 0.44
CYP2C9 P11712 1/20 0.44
NPC1 O15118 1/20 0.42
TSHR P16473 1/20 0.42
MAPK1 P28482 1/20 0.42
RAB9A P51151 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
KMT2A Q03164 1/20 0.42
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
Acetonitrile SCHEMBL28272236 0.90 HPGD (0.47) HPGDSMN1; SMN2ABL1TAAR1DRD4
SCHEMBL30505689 0.85 CYP2C9 (0.50) HPGDSMN1; SMN2TAAR1CYP2C9NPC1
SCHEMBL3456460 0.85 HPGD (0.44) HPGDSMN1; SMN2ABL1TAAR1DRD4
SCHEMBL7025724 0.79 MEN1 (0.49) HPGDSMN1; SMN2TAAR1DRD4CYP2C9
SCHEMBL28468257 0.79 MEN1 (0.46) HPGDSMN1; SMN2TAAR1DRD4DRD3
SCHEMBL4218262 0.78 TAAR1 (0.47) HPGDSMN1; SMN2TAAR1DRD4DRD3
SCHEMBL28226695 0.77 TAAR1 (0.62) HPGDSMN1; SMN2TAAR1CYP2C9TSHR
SCHEMBL9353749 0.77 LMNA (0.41) HPGDSMN1; SMN2TAAR1CYP2C9NPC1
SCHEMBL27288253 0.77 TAAR1 (0.39) HPGDSMN1; SMN2ABL1TAAR1DRD4
Acetonitrile SCHEMBL28270697 0.77 KDM4E (0.45) HPGDSMN1; SMN2TAAR1DRD4DRD3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117924295-A Furimazine derivative and preparation method and application thereof 广州博鹭腾生物科技有限公司 2024-04-26 CN disclosed
EP-0667855-A4 SUBSTITUTED ARYLALKYNYL- AND HETEROARYLALKYNYL-N-HYDROXYUREA INHIBITORS OF LEUKOTRIENE BIOSYNTHESIS. ABBOTT LAB (US) 1996-02-21 EP disclosed
EP-0667855-A1 SUBSTITUTED ARYLALKYNYL- AND HETEROARYLALKYNYL-N-HYDROXYUREA INHIBITORS OF LEUKOTRIENE BIOSYNTHESIS ABBOTT LABORATORIES (US) 1995-08-23 EP disclosed
WO-1994011342-A1 SUBSTITUTED ARYLALKYNYL- AND HETEROARYLALKYNYL-N-HYDROXYUREA INHIBITORS OF LEUKOTRIENE BIOSYNTHESIS ABBOTT LABORATORIES (US) 1994-05-26 WO disclosed