SCHEMBL8480288

SCHEMBL8480288

CC(=O)c1sc(Cl)nc1C

nearest known ligand 0.70

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.70
HPGD P15428 1/20 0.70
TSHR P16473 1/20 0.70
RAB9A P51151 2/20 0.54
KMT2A Q03164 6/20 0.51
PKM P14618 1/20 0.51
L3MBTL1 Q9Y468 3/20 0.47
RXFP1 Q9HBX9 2/20 0.47
NPC1 O15118 1/20 0.47
NPSR1 Q6W5P4 1/20 0.47
CYP1A2 P05177 1/20 0.47
GAA P10253 1/20 0.47
CYP2C9 P11712 1/20 0.47

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
SCHEMBL3500221 0.83 ALDH1A1 (0.70) ALDH1A1HPGDTSHRRAB9AKMT2A
SCHEMBL2514326 0.83 ALDH1A1 (1.00) ALDH1A1HPGDTSHRRAB9AKMT2A
SCHEMBL8524708 0.82 ALDH1A1 (0.50) ALDH1A1HPGDTSHRRAB9AKMT2A
Hydrochloric Acid SCHEMBL8761196 0.81 ALDH1A1 (0.96) ALDH1A1HPGDTSHRRAB9AKMT2A
SCHEMBL27259598 0.80 ALDH1A1 (0.50) ALDH1A1HPGDTSHRRAB9AKMT2A
SCHEMBL11997548 0.78 RAB9A (0.50) ALDH1A1HPGDTSHRRAB9AKMT2A
SCHEMBL19067683 0.78 ALDH1A1 (0.63) ALDH1A1HPGDTSHRRAB9AKMT2A
SCHEMBL19981322 0.78 HPGD (0.63) ALDH1A1HPGDTSHRRAB9AKMT2A
SCHEMBL29198580 0.78 ALDH1A1 (0.63) ALDH1A1HPGDTSHRRAB9AKMT2A
SCHEMBL211358 0.77 RXFP1 (0.50) ALDH1A1HPGDTSHRRAB9AKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2024026481-A2 CDK2 INHIBITORS AND METHODS OF USING THE SAME CEDILLA THERAPEUTICS, INC. (US) 2024-02-01 WO disclosed
WO-2024026486-A2 CDK2 INHIBITORS AND METHODS OF USING THE SAME CEDILLA THERAPEUTICS, INC. (US) 2024-02-01 WO disclosed
WO-2024026479-A2 CDK2 INHIBITORS AND METHODS OF USING THE SAME CEDILLA THERAPEUTICS, INC. (US) 2024-02-01 WO disclosed
CN-108727368-B Nitrogen-containing fused heterocyclic compound, preparation method, intermediate, composition and application thereof 上海医药集团股份有限公司 2022-05-03 CN disclosed
WO-1999018102-A1 FUNGICIDAL AND ARTHROPODICIDAL CYCLIC AMIDES E.I. DU PONT DE NEMOURS AND COMPANY (US) 1999-04-15 WO disclosed