SCHEMBL7987541

SCHEMBL7987541

Nc1ccc(C(=O)NC2CC2)c(F)c1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CRBN Q96SW2 2/20 0.60
HPGD P15428 3/20 0.55
HRH3 Q9Y5N1 2/20 0.52
SMYD3 Q9H7B4 2/20 0.50
KDM1A O60341 1/20 0.47
MAOA P21397 1/20 0.47
NPC1 O15118 2/20 0.47
RAB9A P51151 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.47
TAS1R3 Q7RTX0 1/20 0.44
TAS1R1 Q7RTX1 1/20 0.44
TAS1R2 Q8TE23 1/20 0.44
MEN1 O00255 1/20 0.44
KMT2A Q03164 1/20 0.44
L3MBTL1 Q9Y468 2/20 0.43
ALDH1A1 P00352 2/20 0.43
POLB P06746 1/20 0.43
P2RX7 Q99572 1/20 0.43
MAP4K4 O95819 1/20 0.43
KDM4E B2RXH2 1/20 0.42

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
SCHEMBL31567826 1.00 CRBN (0.60) CRBNHPGDHRH3SMYD3KDM1A
SCHEMBL13498283 0.94 CRBN (0.57) CRBNHPGDHRH3KDM1AMAOA
SCHEMBL1781864 0.89 ACKR3 (0.55) CRBNHRH3MEN1KMT2AALDH1A1
SCHEMBL28189608 0.84 HDAC4 (0.55) CRBNHRH3
SCHEMBL28189609 0.84 HDAC4 (0.55) CRBNHRH3
SCHEMBL14454263 0.84 HRH3 (0.49) CRBNHPGDHRH3SMN1; SMN2MEN1
SCHEMBL4191547 0.83 HPGD (0.71) HPGDHRH3SMYD3NPC1RAB9A
SCHEMBL19990874 0.82 CRBN (0.50) CRBNHRH3NPC1SMN1; SMN2ALDH1A1
SCHEMBL18115907 0.82 CRBN (0.50) CRBNHRH3NPC1SMN1; SMN2ALDH1A1
SCHEMBL3225623 0.81 HPGD (0.55) CRBNHPGDHRH3KDM1AMAOA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116262736-A Novel oxo-pyridine compound and preparation method and application thereof 成都施贝康生物医药科技有限公司 2023-06-16 CN disclosed
EP-2298747-A1 TRIAZOLE DERIVATIVE OR SALT THEREOF Astellas Pharma Inc. (JP) 2011-03-23 EP disclosed
WO-2010001946-A1 TRIAZOLE DERIVATIVE OR SALT THEREOF アステラス製薬株式会社 (JP) 2010-01-07 WO disclosed