SCHEMBL30848409

SCHEMBL30848409

COc1ccccc1C(=O)NC(C)C(F)F

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HPGD P15428 3/20 0.64
ALDH1A1 P00352 1/20 0.64
L3MBTL1 Q9Y468 1/20 0.57
CTSD P07339 1/20 0.57
NPC1 O15118 2/20 0.55
SMN1; SMN2 Q16637 2/20 0.55
STAT3 P40763 1/20 0.54
RAB9A P51151 3/20 0.53
GAA P10253 2/20 0.52
KCNK3 O14649 2/20 0.51
KCNK9 Q9NPC2 2/20 0.51
TSHR P16473 2/20 0.51
MAPT P10636 1/20 0.50
MAPK1 P28482 1/20 0.50
HSD17B10 Q99714 1/20 0.50
RXFP1 Q9HBX9 1/20 0.50
TP53 P04637 1/20 0.50
GLA P06280 1/20 0.50
KCNA3 P22001 1/20 0.50
LMNA P02545 1/20 0.50

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
SCHEMBL24568217 0.87 HPGD (0.68) HPGDALDH1A1L3MBTL1CTSDNPC1
SCHEMBL24801412 0.87 HPGD (0.68) HPGDALDH1A1L3MBTL1CTSDNPC1
SCHEMBL28983001 0.86 HPGD (0.61) HPGDALDH1A1L3MBTL1CTSDNPC1
SCHEMBL18893131 0.85 L3MBTL1 (0.74) HPGDALDH1A1L3MBTL1CTSDNPC1
SCHEMBL8029750 0.82 HPGD (0.69) HPGDALDH1A1L3MBTL1CTSDNPC1
SCHEMBL28239683 0.81 HPGD (0.60) HPGDALDH1A1L3MBTL1CTSDNPC1
Alcohol SCHEMBL6836623 0.81 L3MBTL1 (0.68) HPGDALDH1A1L3MBTL1CTSDNPC1
SCHEMBL2251629 0.79 HPGD (0.70) HPGDALDH1A1L3MBTL1CTSDNPC1
SCHEMBL29894117 0.79 HPGD (0.70) HPGDALDH1A1L3MBTL1CTSDNPC1
SCHEMBL2792267 0.79 HPGD (0.70) HPGDALDH1A1L3MBTL1CTSDNPC1

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
CN-118043327-A FGFR inhibitors and methods of use thereof 思康睿奇(上海)药业有限公司 2024-05-14 CN claimed
CN-118043327-A FGFR inhibitors and methods of use thereof 思康睿奇(上海)药业有限公司 2024-05-14 CN disclosed