SCHEMBL24632522

SCHEMBL24632522

CC(=O)NC1CCC(c2ccc(C)cc2F)CC1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTR2A P28223 2/20 0.42
DRD3 P35462 2/20 0.42
DRD2 P14416 1/20 0.42
TAS1R3 Q7RTX0 1/20 0.41
TAS1R1 Q7RTX1 1/20 0.41
TAS1R2 Q8TE23 1/20 0.41
OPRL1 P41146 1/20 0.40
DRD4 P21917 1/20 0.40
NPC1 O15118 5/20 0.40
RAB9A P51151 5/20 0.40
PDE4B Q07343 1/20 0.39
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
POLB P06746 1/20 0.38
PDE2A O00408 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.37
CYP1A2 P05177 1/20 0.37
HPGD P15428 1/20 0.37
CYP2C19 P33261 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37

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
SCHEMBL24632523 0.86 NPC1 (0.42) TAS1R3TAS1R1TAS1R2OPRL1DRD4
SCHEMBL21267593 0.82 PDE2A (0.45) HTR2ADRD3DRD2OPRL1PDE2A
SCHEMBL16962148 0.81 SLC6A2 (0.43) OPRL1DRD4PDE2A
SCHEMBL24632926 0.80 OPRL1 (0.40) OPRL1DRD4PDE2A
SCHEMBL24632526 0.77 HCRTR2 (0.43) HTR2ADRD3DRD2KMT2AL3MBTL1
SCHEMBL28397690 0.77 EPHX2 (0.44) HTR2ADRD3TAS1R3TAS1R1TAS1R2
SCHEMBL18503369 0.75 SLC6A2 (0.39) TAS1R3TAS1R1TAS1R2OPRL1DRD4
SCHEMBL13499926 0.74 PTGDR2 (0.42) OPRL1DRD4NPC1RAB9A
SCHEMBL6433955 0.74 TYR (0.45) HTR2ADRD3DRD2TAS1R3TAS1R1
SCHEMBL14864497 0.73 PTGDR2 (0.44) OPRL1NPC1RAB9ASMN1; SMN2

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
US-20230062022-A1 HETEROCYCLIC COMPOUNDS AS KINASE INHIBITORS NUVATION BIO INC (US) 2023-03-02 US disclosed
WO-2022236253-A1 HETEROCYCLIC COMPOUNDS AS KINASE INHIBITORS NUVATION BIO INC. (US) 2022-11-10 WO disclosed
WO-2022236256-A1 HETEROCYCLIC COMPOUNDS AS KINASE INHIBITORS NUVATION BIO INC. (US) 2022-11-10 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20230062022-A1 HETEROCYCLIC COMPOUNDS AS KINASE INHIBITORS CDK4, CDK6, CDK8 HTR2A 3609/4885DRD3 2606/4885DRD2 2586/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.