SCHEMBL24926677

SCHEMBL24926677

CC(C)c1nccnc1-c1ccc(C(F)(F)F)cn1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPSR1 Q6W5P4 2/20 0.40
KDM4E B2RXH2 2/20 0.40
POLB P06746 2/20 0.38
TRPV1 Q8NER1 3/20 0.38
TRPV3 Q8NET8 1/20 0.38
KIF11 P52732 1/20 0.37
SYK P43405 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
ALDH1A1 P00352 1/20 0.35
LMNA P02545 1/20 0.35
RAB9A P51151 1/20 0.35
OGA O60502 1/20 0.35
KMT2A Q03164 1/20 0.35
KDM1A O60341 2/20 0.35
MAOB P27338 1/20 0.35
RET P07949 1/20 0.34
CASP3 P42574 1/20 0.33
CETP P11597 1/20 0.33
SMO Q99835 1/20 0.33
MAPK3 P27361 1/20 0.33

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
SCHEMBL29775988 0.88 KDM4E (0.39) NPSR1KDM4EPOLBTRPV1TRPV3
SCHEMBL29776077 0.88 NPSR1 (0.39) NPSR1KDM4EPOLBTRPV1TRPV3
SCHEMBL23212679 0.88 KDM4E (0.39) NPSR1KDM4EPOLBTRPV1TRPV3
SCHEMBL23213901 0.88 NPSR1 (0.39) NPSR1KDM4EPOLBTRPV1TRPV3
SCHEMBL23329670 0.79 TGFBR1 (0.36) TRPV3SYK
SCHEMBL12277748 0.79 KIF11 (0.46) TRPV1TRPV3KIF11
SCHEMBL29776111 0.78 LIPE (0.38) NPSR1KDM4ETRPV1SYKL3MBTL1
SCHEMBL30010484 0.77 TRPV1 (0.35) KDM4ETRPV1TRPV3SYKL3MBTL1
SCHEMBL23213969 0.77 TRPV1 (0.35) KDM4ETRPV1TRPV3SYKL3MBTL1
SCHEMBL23329668 0.76 GBA1 (0.33) KDM4EL3MBTL1ALDH1A1RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230023326-A1 HETEROARYL-SUBSTITUTED PYRAZINE DERIVATIVES AS PESTICIDES ELANCO ANIMAL HEALTH GMBH (DE) 2023-01-26 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-20230023326-A1 HETEROARYL-SUBSTITUTED PYRAZINE DERIVATIVES AS PESTICIDES DDT, PRXL2A, CAT NPSR1 253/4885KDM4E 2574/4885POLB 4537/4885

“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.