SCHEMBL30949650

SCHEMBL30949650

COC(=O)c1cc(C)ccc1-c1ccccc1F

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP46A1 Q9Y6A2 1/20 0.55
SLC6A4 P31645 3/20 0.48
SLC6A3 Q01959 3/20 0.48
NPC1 O15118 2/20 0.45
RAB9A P51151 2/20 0.45
KMT2A Q03164 2/20 0.45
HPGD P15428 1/20 0.45
SMN1; SMN2 Q16637 1/20 0.45
HSD17B10 Q99714 1/20 0.45
MAPT P10636 2/20 0.45
HSP90AA1 P07900 1/20 0.45
HTT P42858 1/20 0.45
NPSR1 Q6W5P4 1/20 0.45
DHODH Q02127 2/20 0.44
GRM2 Q14416 2/20 0.44
KDM4E B2RXH2 2/20 0.43
TUBB4A P04350 1/20 0.43
TUBB P07437 1/20 0.43
TUBA3C P0DPH7 1/20 0.43
TUBA1B P68363 1/20 0.43

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
SCHEMBL25474566 0.88 CYP46A1 (0.57) CYP46A1SLC6A4SLC6A3NPC1RAB9A
SCHEMBL12192433 0.85 ALDH1A1 (0.51) SLC6A4SLC6A3NPC1RAB9AKMT2A
SCHEMBL30876354 0.84 SLC6A3 (0.65) SLC6A4SLC6A3NPC1RAB9AKMT2A
SCHEMBL27324419 0.84 SLC6A3 (0.65) SLC6A4SLC6A3NPC1RAB9AKMT2A
SCHEMBL29706660 0.84 GAA (0.50) SLC6A4SLC6A3NPC1RAB9AKMT2A
SCHEMBL24390973 0.83 CYP46A1 (0.56) CYP46A1SLC6A4SLC6A3HSD17B10MAPT
SCHEMBL2313764 0.82 ALDH1A1 (0.46) SLC6A4SLC6A3NPC1RAB9AKMT2A
SCHEMBL6838053 0.82 BDKRB1 (0.50) CYP46A1HSD17B10
SCHEMBL2313608 0.81 HPGD (0.51) SLC6A4SLC6A3NPC1RAB9AKMT2A
SCHEMBL30313770 0.81 KDM4E (0.55) CYP46A1NPC1RAB9ASMN1; SMN2MAPT

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
EP-4652154-A1 NOVEL ALPK1 INHIBITORS Pyrotech (Beijing) Biotechnology Co., Ltd. (CN) 2025-11-26 EP disclosed
WO-2024153225-A1 NOVEL ALPK1 INHIBITORS PYROTECH (BEIJING) BIOTECHNOLOGY CO., LTD. (CN) 2024-07-25 WO disclosed