SCHEMBL7690663

SCHEMBL7690663

OCCCn1c(COc2ccc(Cl)cc2)nc2cc(Cl)ccc21

nearest known ligand 0.60

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
NUDT1 P36639 1/20 0.60
BACE1 P56817 1/20 0.60
NPY1R P25929 8/20 0.55
TP53 P04637 4/20 0.53
MAPT P10636 3/20 0.49
SMN1; SMN2 Q16637 2/20 0.49
KMT2A Q03164 2/20 0.49
MEN1 O00255 1/20 0.45

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
SCHEMBL7689386 0.89 NPY1R (0.52) NUDT1BACE1NPY1RTP53MAPT
SCHEMBL7686231 0.88 NPY1R (0.55) NUDT1BACE1NPY1RTP53MAPT
SCHEMBL7951612 0.88 NPY1R (0.71) NPY1RTP53MAPTSMN1; SMN2KMT2A
SCHEMBL7688799 0.87 TP53 (0.53) NUDT1BACE1NPY1RTP53MAPT
SCHEMBL7690760 0.83 NPY1R (0.80) NPY1RTP53
SCHEMBL11201306 0.81 BACE1 (0.67) NUDT1BACE1TP53MAPTSMN1; SMN2
SCHEMBL23100636 0.78 BACE1 (0.63) NUDT1BACE1TP53MAPTSMN1; SMN2
SCHEMBL7689103 0.77 NPY1R (0.60) NPY1R
SCHEMBL7682934 0.77 NPY1R (0.52) NPY1RTP53MAPTSMN1; SMN2
SCHEMBL7688977 0.77 NPY1R (0.69) NPY1RTP53

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-20020007071-A1 Benzimidzolyl neuropeptide Y receptor antagonists BRITTON THOMAS CHARLES (US) 2002-01-17 US disclosed
US-6255494-B1 SUBSTITUTED BENZIMIDAZOLES USEFUL IN TREATING OR PREVENTING CONDITIONS ASSOCIATED WITH EXCESS OF NEUROPEPTIDE Y (AROUND ARTERIES IN HEART, RESPIRATORY TRACT, GASTROINTESTINAL TRACT AND GENITOURINARY TRACT); ETIOLOGY OF PSYCHIATRIC DISORDERS ELI LILLY AND COMPANY 2001-07-03 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-20020007071-A1 Benzimidzolyl neuropeptide Y receptor antagonists NPY1R, NPY2R, NPY5R NUDT1 4206/4885BACE1 1323/4885NPY1R 1/4885

“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.