SCHEMBL8914064

SCHEMBL8914064

NC1=CC=C(c2ccc(N)cc2)C(Cl)(Cl)C1

nearest known ligand 0.37

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 2/20 0.37
TDP1 Q9NUW8 2/20 0.37
ALDH1A1 P00352 1/20 0.37
TP53 P04637 1/20 0.37
TAAR1 Q96RJ0 1/20 0.32
HSD17B10 Q99714 1/20 0.32
MEN1 O00255 1/20 0.31
MAPT P10636 1/20 0.31
KMT2A Q03164 1/20 0.31
APP P05067 1/20 0.30

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
SCHEMBL4438733 0.82 CYP3A4 (0.39) CYP3A4TDP1ALDH1A1TP53TAAR1
SCHEMBL8086732 0.77 CYP3A4 (0.37) CYP3A4TDP1ALDH1A1TP53TAAR1
SCHEMBL2807841 0.77 CYP3A4 (0.37) CYP3A4TDP1ALDH1A1TP53TAAR1
SCHEMBL3787796 0.73 TDP1 (0.33) CYP3A4TDP1ALDH1A1TP53HSD17B10
SCHEMBL298214 0.73 KIF11 (0.37) CYP3A4TDP1ALDH1A1TP53
SCHEMBL8089981 0.73 ALDH1A1 (0.33) CYP3A4TDP1ALDH1A1TP53
SCHEMBL5080738 0.70 ALDH1A1 (0.36) CYP3A4TDP1ALDH1A1TP53HSD17B10
SCHEMBL844893 0.65 CYP3A4 (0.37) CYP3A4TDP1ALDH1A1TP53TAAR1
Hydrochloric Acid SCHEMBL7556367 0.64 CYP3A4 (0.36) CYP3A4TDP1ALDH1A1TP53TAAR1
Hydrochloric Acid SCHEMBL18986246 0.63 CYP3A4 (0.34) CYP3A4TDP1ALDH1A1TP53TAAR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0043675-B1 MODIFIED HEMOGLOBINS SUITABLE FOR USE AS OXYGEN CARRIERS FOR BLOOD SUBSTITUTES AJINOMOTO CO., INC. (JP) 1984-10-03 EP claimed
US-4377512-A ESTERIFICATION INULIN AND REACTING WITH HEMOGLOBIN AJINOMOTO CO., INC. (JP) 1983-03-22 US claimed
EP-0043675-A1 Modified hemoglobins suitable for use as oxygen carriers for blood substitutes AJINOMOTO CO., INC. (JP) 1982-01-13 EP claimed
US-20260131280-A1 GAS SEPARATION MEMBRANE UNIT, GAS SEPARATION SYSTEM, AND METHOD FOR PRODUCING ENRICHED GAS UBE CORP (JP) 2026-05-14 US disclosed
CN-103796674-A Composition with means for targeting at least one antigen to dendritic cells INST CURIE 2014-05-14 CN disclosed
US-5691443-A AROMATIC POLYAMIDES FOR ROPES AND COMPOSITES E. I. DU PONT DE NEMOURS AND COMPANY (US) 1997-11-25 US disclosed
US-5459231-A Comonomers of 2,2*-disubstituted-4,4*-diaminobiphenyls, terephthalic acid, and p-phenylenediamine; composites, ropes E. I. DU PONT DE NEMOURS AND COMPANY (US) 1995-10-17 US disclosed
US-4530993-A Poly 2,2'-dichloro-4,4'-biphenylene pyromellitimide film DIRECTOR GENERAL OF AGENCY OF INDUSTRIAL SCIENCE & TECHNOLOGY (JP) 1985-07-23 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-20260131280-A1 GAS SEPARATION MEMBRANE UNIT, GAS SEPARATION SYSTEM, AND METHOD FOR PRODUCING ENRICHED GAS SCO2, SLC2A4, STOML2 CYP3A4 1207/4885TDP1 4647/4885ALDH1A1 4807/4885

“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.