SCHEMBL6351385

SCHEMBL6351385

O/N=C(/CCN1CCC(c2cnccn2)C1)c1ccc(F)cc1

nearest known ligand 0.46

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
NAMPT P43490 1/20 0.46
CYP2C9 P11712 1/20 0.46
EPHX2 P34913 1/20 0.46
DRD4 P21917 11/20 0.46
SIGMAR1 Q99720 4/20 0.45
TMEM97 Q5BJF2 3/20 0.45
DRD2 P14416 5/20 0.42
PDCD1LG2 Q9BQ51 1/20 0.36
CD274 Q9NZQ7 1/20 0.36
HTR2A P28223 1/20 0.36
PRCP P42785 1/20 0.35

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
SCHEMBL6351170 1.00 NAMPT (0.46) NAMPTCYP2C9EPHX2DRD4SIGMAR1
SCHEMBL6351165 1.00 NAMPT (0.46) NAMPTCYP2C9EPHX2DRD4SIGMAR1
SCHEMBL6351436 0.89 DRD4 (0.48) NAMPTCYP2C9EPHX2DRD4SIGMAR1
SCHEMBL6351432 0.89 DRD4 (0.48) NAMPTCYP2C9EPHX2DRD4SIGMAR1
SCHEMBL6349707 0.88 DRD4 (0.58) NAMPTCYP2C9EPHX2DRD4DRD2
SCHEMBL6349712 0.88 DRD4 (0.58) NAMPTCYP2C9EPHX2DRD4DRD2
SCHEMBL6352358 0.88 DRD4 (0.58) NAMPTCYP2C9EPHX2DRD4DRD2
SCHEMBL6360058 0.85 CYP2C9 (0.52) NAMPTCYP2C9EPHX2DRD4SIGMAR1
SCHEMBL6351411 0.79 DRD4 (0.52) NAMPTCYP2C9EPHX2DRD4DRD2
SCHEMBL6351409 0.79 DRD4 (0.52) NAMPTCYP2C9EPHX2DRD4DRD2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20050176727-A1 Oximes and hydrazones that are useful in treating sexual dysfunction ABBOTT LABORATORIES 2005-08-11 US claimed
US-20050176727-A1 Oximes and hydrazones that are useful in treating sexual dysfunction ABBOTT LABORATORIES 2005-08-11 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-20050176727-A1 Oximes and hydrazones that are useful in treating sexual dysfunction CYP19A1, SHBG, CYP17A1 NAMPT 2899/4885CYP2C9 290/4885EPHX2 651/4885

“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.