SCHEMBL23957140

SCHEMBL23957140

O=C(NCc1ccc2[nH]ccc2c1)N1CCC2(CCc3ccccc3O2)CC1

nearest known ligand 0.53

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ TRPM8 Q7Z2W7 2/20 0.53
▸ EPHX2 P34913 3/20 0.49
▸ EPHX1 P07099 2/20 0.49
▸ CYP2D6 P10635 1/20 0.49
▸ CHRNA7 P36544 9/20 0.48
▸ FAAH O00519 1/20 0.46
▸ KCNH2 Q12809 2/20 0.43
▸ DRD2 P14416 1/20 0.43
▸ HTR2A P28223 1/20 0.43
▸ SIGMAR1 Q99720 1/20 0.42
▸ SCD O00767 1/20 0.42
▸ OPRK1 P41145 1/20 0.42
▸ ADRA1D P25100 1/20 0.41
▸ ADRA1A P35348 1/20 0.41
▸ ADRA1B P35368 1/20 0.41

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
SCHEMBL23957136 0.88 CHRNA7 (0.44) TRPM8EPHX2EPHX1CYP2D6CHRNA7
SCHEMBL23957152 0.81 CHRNA7 (0.66) TRPM8EPHX2CHRNA7FAAH
SCHEMBL23957090 0.78 CHRNA7 (0.55) EPHX2EPHX1CYP2D6CHRNA7KCNH2
SCHEMBL23957121 0.78 CHRNA7 (0.65) EPHX2EPHX1CYP2D6CHRNA7KCNH2
SCHEMBL1912695 0.78 TRPM8 (0.68) TRPM8EPHX2EPHX1KCNH2DRD2
SCHEMBL23928852 0.72 CHRNA7 (0.72) CHRNA7
SCHEMBL1912694 0.72 TRPM8 (0.73) TRPM8EPHX2EPHX1KCNH2DRD2
SCHEMBL23957115 0.71 CHRNA7 (0.76) EPHX2EPHX1CYP2D6CHRNA7KCNH2
SCHEMBL23928897 0.71 CHRNA7 (0.64) EPHX2EPHX1CYP2D6CHRNA7KCNH2
SCHEMBL31020809 0.71 CHRNA7 (0.64) EPHX2EPHX1CYP2D6CHRNA7KCNH2

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-20210330650-A1 SPIROCHROMANE DERIVATIVES RICHTER GEDEON NYRT. (HU) 2021-10-28 — — 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-20210330650-A1 SPIROCHROMANE DERIVATIVES CHRNA7, CHRM3, ADRB3 TRPM8 60/4885EPHX2 1079/4885EPHX1 955/4885

“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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