SCHEMBL19078796

SCHEMBL19078796

Cc1cnn(C(=O)N2CCN(Cc3cccc(F)c3)CC2)c1

nearest known ligand 0.75

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ CYP2D6 P10635 1/20 0.56
▸ CYP2C9 P11712 1/20 0.56
▸ ALOX15 P16050 1/20 0.56
▸ TSHR P16473 1/20 0.56
▸ CYP2C19 P33261 1/20 0.56
▸ KDM4E B2RXH2 2/20 0.53
▸ ALDH1A1 P00352 2/20 0.53
▸ FAAH O00519 1/20 0.52

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
SCHEMBL19078731 0.90 ALDH1A1 (0.59) KDM4EALDH1A1FAAH
SCHEMBL19078801 0.88 — —
SCHEMBL19078780 0.87 FAAH (0.54) FAAH
SCHEMBL17276459 0.86 LMNA (0.54) —
SCHEMBL19078737 0.86 ALDH1A1 (0.55) KDM4EALDH1A1FAAH
SCHEMBL17276567 0.86 KDM4E (0.52) CYP2D6CYP2C9ALOX15TSHRCYP2C19
SCHEMBL19078797 0.84 — —
SCHEMBL20557070 0.83 — —
SCHEMBL17276607 0.83 FAAH (0.68) KDM4EALDH1A1FAAH
SCHEMBL17276610 0.82 FAAH (0.55) FAAH

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-20170190669-A1 PYRAZOLE COMPOUNDS AND METHODS OF MAKING AND USING SAME H. LUNDBECK A/S (DK) 2017-07-06 — — 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-20170190669-A1 PYRAZOLE COMPOUNDS AND METHODS OF MAKING AND USING SAME ABHD6, FAAH, FAAH2 CYP2D6 64/4885CYP2C9 1554/4885ALOX15 215/4885

“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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