SCHEMBL31566015

SCHEMBL31566015

O=C(NC1CCOC1)N1CCc2ccc(Oc3ccc(C(F)(F)F)cc3)cc2C1

nearest known ligand 0.46

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ CCR2 P41597 5/20 0.46
▸ KCNH2 Q12809 4/20 0.46
▸ NAMPT P43490 5/20 0.44
▸ SCN9A Q15858 3/20 0.44
▸ SCN7A Q01118 1/20 0.44
▸ SCN5A Q14524 1/20 0.44
▸ OGA O60502 1/20 0.41
▸ POLB P06746 1/20 0.41
▸ GABRG2 P18507 1/20 0.41
▸ GABRB3 P28472 1/20 0.41
▸ GABRA5 P31644 1/20 0.41
▸ EPHX2 P34913 2/20 0.40
▸ ESR1 P03372 1/20 0.40
▸ ESR2 Q92731 1/20 0.40

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
SCHEMBL31566060 0.89 POLB (0.49) CCR2POLBEPHX2ESR1ESR2
SCHEMBL31566056 0.88 POLB (0.56) CCR2KCNH2NAMPTPOLBEPHX2
SCHEMBL31565954 0.81 NAMPT (0.44) CCR2KCNH2NAMPTSCN9AESR1
SCHEMBL31566016 0.80 ESR1 (0.47) CCR2KCNH2NAMPTSCN9ASCN7A
SCHEMBL31565984 0.79 CCR2 (0.44) CCR2KCNH2NAMPTEPHX2ESR1
SCHEMBL31566007 0.78 HRH3 (0.57) CCR2ESR1ESR2
SCHEMBL31565948 0.78 LIPE (0.48) SCN9APOLBESR1ESR2
SCHEMBL3989312 0.78 LIPE (0.48) KCNH2SCN9ASCN7AESR1ESR2
SCHEMBL31565963 0.77 ESR1 (0.45) KCNH2SCN9ASCN7AESR1ESR2
SCHEMBL31566067 0.77 ABHD6 (0.52) CCR2SCN9AESR1ESR2

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
US-20250129028-A1 COMPOUNDS AND METHODS FOR YAP/TEAD MODULATION AND INDICATIONS THEREFOR Opna Bio SA (CH) 2025-04-24 — — US 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-20250129028-A1 COMPOUNDS AND METHODS FOR YAP/TEAD MODULATION AND INDICATIONS THEREFOR YAP1, YES1, LATS1 CCR2 3845/4885KCNH2 3526/4885NAMPT 3316/4885

“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.

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