SCHEMBL31737166

SCHEMBL31737166

O=CC1(c2ccc3c(c2)COC3=O)CCN(Cc2ccccc2)CC1

nearest known ligand 0.44

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
KCNJ1 P48048 2/20 0.44
KCNH2 Q12809 1/20 0.44
MAOA P21397 1/20 0.44
MAOB P27338 1/20 0.44
SIGMAR1 Q99720 9/20 0.43
DRD2 P14416 2/20 0.42
HTR2A P28223 2/20 0.42
HTR2C P28335 2/20 0.42
HTR2B P41595 2/20 0.42
NPSR1 Q6W5P4 1/20 0.41
OPRL1 P41146 1/20 0.40
CCR3 P51677 1/20 0.40
OPRM1 P35372 1/20 0.40
POLB P06746 1/20 0.40
CYP3A4 P08684 1/20 0.39
HSD17B10 Q99714 1/20 0.39

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
SCHEMBL31737152 0.81 KCNJ1 (0.44) KCNJ1KCNH2MAOAMAOBSIGMAR1
SCHEMBL10965632 0.78 OPRL1 (0.59) SIGMAR1DRD2HTR2AHTR2CHTR2B
SCHEMBL15190515 0.77 OPRL1 (0.47) SIGMAR1DRD2HTR2AHTR2CHTR2B
SCHEMBL15190527 0.76 CCR3 (0.63) SIGMAR1DRD2OPRL1CCR3OPRM1
SCHEMBL31736923 0.72 DRD2 (0.53) KCNJ1KCNH2MAOAMAOBSIGMAR1
SCHEMBL31737430 0.72 OPRL1 (0.44) SIGMAR1OPRL1CCR3OPRM1POLB
SCHEMBL701015 0.71 OPRL1 (0.59) SIGMAR1OPRL1OPRM1POLB
SCHEMBL26135570 0.70 SIGMAR1 (0.63) SIGMAR1
SCHEMBL698466 0.69 ALDH1A1 (0.54) SIGMAR1OPRL1OPRM1POLBCYP3A4
SCHEMBL13166827 0.68 CYP3A4 (0.59) SIGMAR1OPRL1CCR3OPRM1POLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2025245178-A1 PAK4, CSTF2, OR CSTF2T PROTEIN DEGRADERS, PHARMACEUTICAL COMPOSITIONS, AND THERAPEUTIC APPLICATIONS INNOVO THERAPEUTICS, INC. (US) 2025-11-27 WO disclosed