SCHEMBL9101507

SCHEMBL9101507

O=C(Nc1ccccc1)c1ncccc1OCC1CCCN1C(=O)c1cccc(C(F)(F)F)c1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.45
HSD11B1 P28845 2/20 0.44
HSD17B1 P14061 1/20 0.44
TRPV1 Q8NER1 3/20 0.43
MEN1 O00255 1/20 0.43
KMT2A Q03164 1/20 0.43
ATR Q13535 1/20 0.42
RHOA P61586 5/20 0.42
KDM4E B2RXH2 2/20 0.42
KCNK3 O14649 1/20 0.42
ALDH1A1 P00352 1/20 0.42
MAPT P10636 1/20 0.42
HTT P42858 1/20 0.42
NPSR1 Q6W5P4 1/20 0.42
RHOC P08134 1/20 0.42
DGAT1 O75907 1/20 0.41
USP2 O75604 1/20 0.41
ALOX15 P16050 1/20 0.41
TSHR P16473 1/20 0.41
HSD17B10 Q99714 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
SCHEMBL9101500 1.00 LMNA (0.45) LMNAHSD11B1HSD17B1TRPV1MEN1
SCHEMBL1241553 0.91 TRPV1 (0.41) LMNATRPV1RHOAKDM4EALDH1A1
SCHEMBL1241557 0.91 TRPV1 (0.41) LMNATRPV1RHOAKDM4EALDH1A1
SCHEMBL1238458 0.89 TRPV1 (0.45) LMNAHSD11B1TRPV1KMT2AKDM4E
SCHEMBL1238462 0.89 TRPV1 (0.45) LMNAHSD11B1TRPV1KMT2AKDM4E
SCHEMBL1241568 0.89 HRH3 (0.46) LMNATRPV1KDM4E
SCHEMBL1241570 0.89 HRH3 (0.46) LMNATRPV1KDM4E
SCHEMBL9102502 0.87 SCD (0.43) LMNATRPV1ALDH1A1
SCHEMBL9102506 0.87 SCD (0.43) LMNATRPV1ALDH1A1
SCHEMBL1241560 0.87 SORT1 (0.43) LMNATRPV1MEN1KMT2ARHOA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8969383-B2 Picolinamide derivatives as TTX-S blockers RAQUALIA PHARMA INC. (JP) 2015-03-03 US disclosed
US-20140296237-A1 PICOLINAMIDE DERIVATIVES AS TTX-S BLOCKERS RAQUALIA PHARMA INC (JP) 2014-10-02 US disclosed
US-8809380-B2 Picolinamide derivatives as TTX-S blockers RAQUALIA PHARMA INC. (JP) 2014-08-19 US disclosed
US-20120142691-A1 PICOLINAMIDE DERIVATIVES AS TTX-S BLOCKERS RAQUALIA PHARMA INC. 2012-06-07 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 (2 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-20120142691-A1 PICOLINAMIDE DERIVATIVES AS TTX-S BLOCKERS CACNA1G, SCN3A, SCN5A LMNA 1079/4885HSD11B1 3744/4885HSD17B1 3616/4885
US-20140296237-A1 PICOLINAMIDE DERIVATIVES AS TTX-S BLOCKERS CACNA1G, SCN3A, SCN5A LMNA 1079/4885HSD11B1 3744/4885HSD17B1 3616/4885

“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.