SCHEMBL7237516

SCHEMBL7237516

O=C1Nc2ccc(F)c(F)c2C(/C=C/C2CC2)(C(F)(F)F)N1

nearest known ligand 0.53

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
ADRA2C P18825 1/20 0.53
TACR2 P21452 1/20 0.53
ADRA1D P25100 1/20 0.53
HTR2A P28223 1/20 0.53
PTH1R Q03431 1/20 0.53

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
SCHEMBL30601634 1.00 ADRA2C (0.53) ADRA2CTACR2ADRA1DHTR2APTH1R
SCHEMBL3496644 1.00 ADRA2C (0.53) ADRA2CTACR2ADRA1DHTR2APTH1R
SCHEMBL29393057 0.80 PDE7A (0.45) ADRA2CTACR2ADRA1DHTR2APTH1R
SCHEMBL1046528 0.80 PDE7A (0.45) ADRA2CTACR2ADRA1DHTR2APTH1R
SCHEMBL1079634 0.80 PDE7A (0.45) ADRA2CTACR2ADRA1DHTR2APTH1R
SCHEMBL4088810 0.80 PDE7A (0.45) ADRA2CTACR2ADRA1DHTR2APTH1R
SCHEMBL7472078 0.74 ADRA2C (0.51) ADRA2CTACR2ADRA1DHTR2APTH1R
SCHEMBL7472072 0.74 ADRA2C (0.51) ADRA2CTACR2ADRA1DHTR2APTH1R
SCHEMBL1153078 0.71 ADRA2C (0.76) ADRA2CTACR2ADRA1DHTR2APTH1R
SCHEMBL1153077 0.71 ADRA2C (0.76) ADRA2CTACR2ADRA1DHTR2APTH1R

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-20030092722-A1 4,4-disubstituted-3,4-dihydro-2(1H)-quinazolines useful as HIV reverse transcriptase inhibitors CORBETT JEFFREY W (US) 2003-05-15 US claimed
US-6423718-B1 4,4-disubstituted-3,4-dihydro-2(1H)-quinazolinones useful as HIV reverse transcriptase inhibitors BRISTOL-MYERS SQUIBB PHARMA COMPANY 2002-07-23 US claimed
US-6124302-A TREATING HIV INFECTIONS DUPONT PHARMACEUTICALS (US) 2000-09-26 US claimed

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-20030092722-A1 4,4-disubstituted-3,4-dihydro-2(1H)-quinazolines useful as HIV reverse transcriptase inhibitors DPYD, NQO2, POLRMT ADRA2C 2165/4885TACR2 3189/4885ADRA1D 1253/4885

“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.