SCHEMBL29807441

SCHEMBL29807441

C=CCOC1Cc2ccccc2C12CCC(Nc1cccc(Cl)c1)(C(=O)O)CC2

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CXCR5 P32302 3/20 0.38
FAAH O00519 1/20 0.37
TRPV1 Q8NER1 1/20 0.37
GRIN2B Q13224 3/20 0.35
NPC1 O15118 5/20 0.35
RAB9A P51151 5/20 0.35
MAOB P27338 3/20 0.35
MEN1 O00255 3/20 0.35
KMT2A Q03164 3/20 0.35
MAOA P21397 2/20 0.35
EGFR P00533 1/20 0.35
MMP1 P03956 1/20 0.35
MMP2 P08253 1/20 0.35
MMP9 P14780 1/20 0.35
MAPT P10636 5/20 0.35
LMNA P02545 2/20 0.34
HTT P42858 2/20 0.34
SMN1; SMN2 Q16637 2/20 0.34
NPSR1 Q6W5P4 1/20 0.34
CASP3 P42574 1/20 0.34

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
SCHEMBL29807247 0.89 FAAH (0.37) CXCR5FAAHTRPV1MAOBMAOA
SCHEMBL29806821 0.89 MAOB (0.44) FAAHTRPV1GRIN2BNPC1RAB9A
SCHEMBL29806299 0.84 SMN1; SMN2 (0.42) FAAHTRPV1GRIN2BNPC1RAB9A
SCHEMBL29807712 0.81 GRIN2B (0.34) FAAHTRPV1GRIN2BNPC1MAOB
SCHEMBL29807587 0.79 GRIN2B (0.41) FAAHTRPV1GRIN2BNPC1RAB9A
SCHEMBL29807405 0.79 GRIN2B (0.41) FAAHTRPV1GRIN2BNPC1RAB9A
SCHEMBL29807750 0.78 GRIN2B (0.41) FAAHTRPV1GRIN2BNPC1RAB9A
SCHEMBL29806677 0.78 GRIN2B (0.39) FAAHTRPV1GRIN2BNPC1RAB9A
SCHEMBL29807126 0.78 RAB9A (0.46) FAAHTRPV1GRIN2BNPC1RAB9A
SCHEMBL29806714 0.77 LMNA (0.41) FAAHTRPV1GRIN2BNPC1RAB9A

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
EP-4277892-A1 SPIROCYCLOHEXANE DERIVATIVES, PHARMACEUTICAL COMPOSITIONS CONTAINING THEM AND THEIR USES AS ANTI-APOPTOTIC INHIBITORS Les Laboratoires Servier (FR) 2023-11-22 EP disclosed
CN-116940552-A Spirocyclic hexane derivatives, pharmaceutical compositions containing them and their use as anti-apoptotic inhibitors 法国施维雅药厂 2023-10-24 CN disclosed
WO-2022152705-A1 SPIROCYCLOHEXANE DERIVATIVES, PHARMACEUTICAL COMPOSITIONS CONTAINING THEM AND THEIR USES AS ANTI-APOPTOTIC INHIBITORS LES LABORATOIRES SERVIER (FR) 2022-07-21 WO disclosed