SCHEMBL22992106

SCHEMBL22992106

CC#Cc1cc(C)c(C2C(=O)CC3(CCN(C(=O)Nc4ccccn4)CC3)CC2=O)c(C)c1

nearest known ligand 0.39

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
FAAH O00519 5/20 0.38
TRPV1 Q8NER1 1/20 0.38
BTK Q06187 4/20 0.35
FNTA P49354 1/20 0.35
FNTB P49356 1/20 0.35
KMT2A Q03164 1/20 0.34
GRM5 P41594 1/20 0.34
KDM4E B2RXH2 1/20 0.34
CYP3A4 P08684 2/20 0.34
TSHR P16473 2/20 0.34
ALDH1A1 P00352 1/20 0.34
HTT P42858 1/20 0.34
CYP2D6 P10635 1/20 0.34
CYP2C19 P33261 1/20 0.34
HSD17B10 Q99714 1/20 0.34

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
SCHEMBL24324680 0.91 NPC1 (0.35) BTKKMT2AGRM5KDM4ECYP3A4
SCHEMBL21344830 0.89 FAAH (0.41) FAAHTRPV1FNTAFNTBKMT2A
SCHEMBL22992194 0.88 TRPV1 (0.36) TRPV1KMT2AALDH1A1
SCHEMBL22942059 0.86 RAB9A (0.35) KMT2AKDM4ECYP3A4TSHRALDH1A1
SCHEMBL22942017 0.86 NPC1 (0.41) GRM5TSHRALDH1A1
SCHEMBL21344636 0.85 L3MBTL1 (0.44) CYP3A4ALDH1A1CYP2D6CYP2C19HSD17B10
SCHEMBL21343728 0.84 CYP3A4 (0.31) KMT2ACYP3A4
SCHEMBL21344667 0.83 SMN1; SMN2 (0.42) FAAHCYP3A4TSHRCYP2D6
SCHEMBL22992236 0.82 NAMPT (0.38) FNTAFNTBKDM4ETSHRALDH1A1
SCHEMBL21344248 0.82 HIF1A (0.32)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12043599-B2 Herbicidal compounds SYNGENTA PARTICIPATIONS AG (CH) 2024-07-23 US disclosed
EP-3762378-B1 HERBICIDAL COMPOUNDS SYNGENTA PARTICIPATIONS AG (CH) 2022-05-18 EP disclosed
US-20210047274-A1 HERBICIDAL COMPOUNDS SYNGENTA PARTICIPATIONS AG (CH) 2021-02-18 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-20210047274-A1 HERBICIDAL COMPOUNDS DDT, CBR3, GLRX3 FAAH 750/4885TRPV1 2779/4885BTK 3741/4885
US-12043599-B2 Herbicidal compounds DDT, CBR3, GLRX3 FAAH 750/4885TRPV1 2779/4885BTK 3741/4885

“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.