SCHEMBL14204722

SCHEMBL14204722

CNCc1c(C)cc(Cl)cc1Cl

nearest known ligand 0.43

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ P2RX7 Q99572 14/20 0.43
▸ RAPGEF4 Q8WZA2 1/20 0.41
▸ EPHX2 P34913 1/20 0.39
▸ SLC6A4 P31645 3/20 0.38
▸ SLC6A2 P23975 1/20 0.38
▸ SLC6A3 Q01959 1/20 0.38
▸ ALDH1A1 P00352 1/20 0.38
▸ HPGD P15428 1/20 0.38
▸ SMN1; SMN2 Q16637 1/20 0.38
▸ HTR2A P28223 2/20 0.36
▸ KCNH2 Q12809 2/20 0.36

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
SCHEMBL15129218 0.77 P2RX7 (0.43) P2RX7RAPGEF4EPHX2ALDH1A1HPGD
SCHEMBL12734252 0.76 P2RX7 (0.54) P2RX7EPHX2
SCHEMBL10051058 0.76 RAPGEF4 (0.41) P2RX7RAPGEF4EPHX2ALDH1A1SMN1; SMN2
SCHEMBL14932492 0.76 RAPGEF4 (0.41) P2RX7RAPGEF4EPHX2SLC6A2SLC6A3
SCHEMBL110348 0.74 KRAS (0.40) P2RX7RAPGEF4ALDH1A1
SCHEMBL6151899 0.74 RAPGEF4 (0.39) P2RX7RAPGEF4ALDH1A1
SCHEMBL6355236 0.74 RAPGEF4 (0.39) P2RX7RAPGEF4EPHX2ALDH1A1SMN1; SMN2
SCHEMBL27129026 0.74 RAPGEF4 (0.39) P2RX7RAPGEF4EPHX2SLC6A2SLC6A3
Hydrochloric Acid SCHEMBL966799 0.72 KRAS (0.39) P2RX7RAPGEF4ALDH1A1
SCHEMBL20306076 0.72 RAPGEF4 (0.38) P2RX7RAPGEF4ALDH1A1SMN1; SMN2

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
EP-3609868-B1 TETRAHYDROQUINOLINE DERIVATIVES AS P2X7 RECEPTOR ANTAGONISTS RAQUALIA PHARMA INC (JP) 2023-10-18 — — EP disclosed
US-10005732-B2 Potent non-urea inhibitors of soluble epoxide hydrolase THE TRUSTEES OF COLUMBIA UNIVERSITY IN THE CITY OF NEW YORK (US) 2018-06-26 — — US disclosed
US-7351742-B2 Sulfonamide derivatives for the treatment of diseases PFIZER INC. (US) 2008-04-01 — — 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-10005732-B2 Potent non-urea inhibitors of soluble epoxide hydrolase EPHX1, EPHX2, ECE1 P2RX7 605/4885RAPGEF4 2540/4885EPHX2 2/4885

“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.

Send feedback