SCHEMBL3595523

SCHEMBL3595523

O=C1CNc2cccc(NC(=O)/C=C3\CCCOc4cc(C(F)(F)F)ccc43)c2C1

nearest known ligand 0.41

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
TRPV1 Q8NER1 12/20 0.41
NPC1 O15118 1/20 0.33
RAB9A P51151 1/20 0.33
KMT2A Q03164 1/20 0.33
KDR P35968 1/20 0.32
CTSL P07711 3/20 0.32
CTSV O60911 1/20 0.32
CTSB P07858 1/20 0.32
CYP3A4 P08684 1/20 0.32
CYP2D6 P10635 1/20 0.32
CYP2C9 P11712 1/20 0.32
CTSS P25774 1/20 0.32

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
SCHEMBL3595530 1.00 TRPV1 (0.41) TRPV1NPC1RAB9AKMT2AKDR
SCHEMBL3588260 0.87 TRPV1 (0.43) TRPV1KDRCTSLCTSVCTSB
SCHEMBL1451099 0.86 TRPV1 (0.40) TRPV1NPC1RAB9AKMT2A
SCHEMBL1451104 0.86 TRPV1 (0.40) TRPV1NPC1RAB9AKMT2A
SCHEMBL1451252 0.86 TRPV1 (0.38) TRPV1NPC1RAB9AKMT2ACTSL
SCHEMBL1451256 0.86 TRPV1 (0.38) TRPV1NPC1RAB9AKMT2ACTSL
SCHEMBL3599187 0.85 TRPV1 (0.46) TRPV1
SCHEMBL3592359 0.84 TRPV1 (0.41) TRPV1
SCHEMBL1451741 0.83 TRPV1 (0.38) TRPV1CTSLCTSVCTSBCYP3A4
SCHEMBL1451749 0.83 TRPV1 (0.38) TRPV1CTSLCTSVCTSBCYP3A4

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-20100016285-A1 HETEROCYCLIDENE-N-(ARYL) ACETAMIDE DERIVATIVE MOCHIDA PHARMACEUTICAL CO., LTD. (JP) 2010-01-21 US disclosed
US-20100016285-A1 HETEROCYCLIDENE-N-(ARYL) ACETAMIDE DERIVATIVE MOCHIDA PHARMACEUTICAL CO., LTD. (JP) 2010-01-21 US disclosed
US-20100016285-A1 HETEROCYCLIDENE-N-(ARYL) ACETAMIDE DERIVATIVE MOCHIDA PHARMACEUTICAL CO., LTD. (JP) 2010-01-21 US disclosed
EP-2128157-A1 HETEROCYCLIDENE-N-(ARYL)ACETAMIDE DERIVATIVE MOCHIDA PHARMACEUTICAL CO., LTD. (JP) 2009-12-02 EP 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-20100016285-A1 HETEROCYCLIDENE-N-(ARYL) ACETAMIDE DERIVATIVE CCNY, CCND3, NSD3 TRPV1 2518/4885NPC1 2542/4885RAB9A 2599/4885

“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.