SCHEMBL7280826

SCHEMBL7280826

O=c1nc(-c2cccnc2)[nH]c2ccccc12

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 4/20 0.63
LDHA P00338 1/20 0.63
EPHX2 P34913 1/20 0.63
HPGD P15428 3/20 0.61
MAPT P10636 5/20 0.59
ALDH1A1 P00352 3/20 0.59
RAB9A P51151 3/20 0.59
NPC1 O15118 2/20 0.59
KMT2A Q03164 2/20 0.59
HTT P42858 2/20 0.59
MEN1 O00255 1/20 0.59
POLB P06746 1/20 0.59
STAT1 P42224 1/20 0.56
SMN1; SMN2 Q16637 1/20 0.56
CYP11B1 P15538 2/20 0.54
CYP11B2 P19099 1/20 0.54
KDM4C Q9H3R0 1/20 0.54
PKN1 Q16512 1/20 0.51
PKN2 Q16513 1/20 0.51
BTK Q06187 1/20 0.50

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
SCHEMBL2823766 0.84 ALDH1A1 (0.64) KDM4EHPGDMAPTALDH1A1RAB9A
SCHEMBL8618963 0.82 ALDH1A1 (0.56) KDM4EHPGDMAPTALDH1A1RAB9A
SCHEMBL7289798 0.82 CYP11B1 (0.67) KDM4ELDHAEPHX2HPGDMAPT
SCHEMBL19196494 0.82 ALDH1A1 (0.43) KDM4ELDHAEPHX2HPGDMAPT
SCHEMBL8620408 0.81 NR1I3 (0.54) KDM4EHPGDMAPTALDH1A1RAB9A
SCHEMBL27126765 0.80 WNT1 (0.69) IDO1LRRK2
SCHEMBL15775281 0.80 KDM4C (0.56) KDM4ELDHAEPHX2HPGDMAPT
SCHEMBL6887071 0.80 ALDH1A1 (0.52) KDM4EHPGDMAPTALDH1A1RAB9A
SCHEMBL24393034 0.79 KDM4E (0.67) KDM4ELDHAEPHX2HPGDMAPT
SCHEMBL14474076 0.79 ALDH1A1 (0.57) KDM4EHPGDMAPTALDH1A1RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20020025968-A1 Method for inhibiting neoplastic cells and related conditions by exposure to 4-aminoquinazoline derivatives OSI PHARMACEUTICALS, INC. 2002-02-28 US disclosed
EP-0579496-B1 4-Aminoquinazoline derivatives, and their use as medicine ONO PHARMACEUTICAL CO (JP) 2001-11-14 EP disclosed
US-5439895-A Cardiovascular disorders; inhibitor of thromboxane A2 synthetase and cyclic guanosine 3',5'-monophosphate ONO PHARMACEUTICAL CO., LTD. (JP) 1995-08-08 US disclosed
US-5436233-A Nervous system disorders ONO PHARMACEUTICAL CO., LTD. (JP) 1995-07-25 US disclosed
EP-0579496-A1 4-Aminoquinazoline derivatives, and their use as medicine ONO PHARMACEUTICAL CO., LTD. (JP) 1994-01-19 EP 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-20020025968-A1 Method for inhibiting neoplastic cells and related conditions by exposure to 4-aminoquinazoline derivatives VHL, MCL1, NFATC1 KDM4E 1236/4885LDHA 3689/4885EPHX2 2982/4885

“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.