SCHEMBL4376237

SCHEMBL4376237

Oc1ccc2[nH]c(Cl)nc2c1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PLAU P00749 1/20 0.43
ALDH1A1 P00352 2/20 0.41
KDM4E B2RXH2 1/20 0.41
HPGD P15428 1/20 0.41
GAA P10253 2/20 0.39
USP2 O75604 1/20 0.39
ALOX15 P16050 1/20 0.39
RAD51 Q06609 1/20 0.39
NPSR1 Q6W5P4 1/20 0.39
ABL1 P00519 1/20 0.39
PDGFRB P09619 1/20 0.39
KIT P10721 1/20 0.39
BCR P11274 1/20 0.39
FLT3 P36888 1/20 0.39
AMY1A P0DUB6 1/20 0.38
NPC1 O15118 1/20 0.38
RAB9A P51151 1/20 0.38
SMAD3 P84022 1/20 0.38
PDE3B Q13370 1/20 0.38
PDE3A Q14432 1/20 0.38

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
SCHEMBL4376248 0.84 PLAU (0.61) PLAUALDH1A1KDM4EHPGDGAA
SCHEMBL1192946 0.79 F7 (0.47) ALDH1A1KDM4EHPGDALOX15NPC1
SCHEMBL14601535 0.79 AMY1A (0.51) PLAUALDH1A1KDM4EHPGDGAA
SCHEMBL18782891 0.76 PLAU (0.43) PLAUALDH1A1KDM4EHPGDGAA
SCHEMBL726012 0.76 PLAU (0.72) PLAUALDH1A1KDM4EHPGDGAA
SCHEMBL7718077 0.76 PLAU (0.43) PLAUALDH1A1KDM4EHPGDGAA
SCHEMBL1405835 0.76 ALDH1A1 (0.47) PLAUALDH1A1KDM4EHPGDGAA
SCHEMBL1747974 0.76 KDM4E (0.42) ALDH1A1KDM4EHPGDAMY1ANPC1
SCHEMBL5787022 0.76 NOS1 (0.41) ALDH1A1KDM4EGAANPC1RAB9A
SCHEMBL1663309 0.76 MAPKAPK2 (0.49) ALDH1A1KDM4EHPGDGAAUSP2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11787791-B2 Inhibitors of VAP-1 ACUCELA INC. (US) 2023-10-17 US disclosed
US-11787791-B2 Inhibitors of VAP-1 ACUCELA INC. (US) 2023-10-17 US disclosed
US-20230295140-A1 INHIBITORS OF VAP-1 ACUCELA INC. 2023-09-21 US disclosed
US-20230295140-A1 INHIBITORS OF VAP-1 ACUCELA INC. 2023-09-21 US disclosed
US-20210387975-A1 INHIBITORS OF VAP-1 ACUCELA INC. 2021-12-16 US disclosed
CN-110903246-A Compound for treating thyroid cancer and composition and medical application thereof 赵洁 2020-03-24 CN disclosed
US-8492560-B2 Quinazoline derivatives as angiogenesis inhibitors ASTRAZENECA AB (SE) 2013-07-23 US disclosed
US-20120197027-A1 Quinazoline Derivatives as Angiogenesis Inhibitors STOKES ELAINE S E (GB) 2012-08-02 US disclosed
EP-2050744-A1 Quinazoline derivatives as angiogenesis inhibitors AstraZeneca AB (SE) 2009-04-22 EP disclosed
US-7074800-B1 Quinazoline derivatives as angiogenesis inhibitors ASTRAZENECA AB (SE) 2006-07-11 US disclosed
US-20060004017-A1 Quinazoline derivatives as angiogenesis inhibitors ASTRAZENECA AB 2006-01-05 US disclosed
EP-1553097-A1 QUINAZOLINE DERIVATIVES AS ANGIOGENESIS INHIBITORS AND INTERMEDIATES THEREFORE AstraZeneca AB (SE) 2005-07-13 EP disclosed
EP-1154774-B1 QUINAZOLINE DERIVATIVES AS ANGIOGENESIS INHIBITORS ASTRAZENECA AB (SE) 2005-06-22 EP disclosed
EP-1154774-A1 QUINAZOLINE DERIVATIVES AS ANGIOGENESIS INHIBITORS AstraZeneca AB (SE) 2001-11-21 EP disclosed
WO-2000047212-A1 QUINAZOLINE DERIVATIVES AS ANGIOGENESIS INHIBITORS ASTRAZENECA AB (SE) 2000-08-17 WO 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 (5 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-11787791-B2 Inhibitors of VAP-1 VAPB, VAPA, TOE1 PLAU 1013/4885ALDH1A1 869/4885KDM4E 3383/4885
US-20230295140-A1 INHIBITORS OF VAP-1 VAPB, VAPA, TOE1 PLAU 1013/4885ALDH1A1 869/4885KDM4E 3383/4885
US-20120197027-A1 Quinazoline Derivatives as Angiogenesis Inhibitors VEGFA, FLT1, KDR PLAU 2070/4885ALDH1A1 822/4885KDM4E 2055/4885
US-20210387975-A1 INHIBITORS OF VAP-1 VAPB, VAPA, TOE1 PLAU 1013/4885ALDH1A1 869/4885KDM4E 3383/4885
US-20060004017-A1 Quinazoline derivatives as angiogenesis inhibitors FLT4, NOS3, FLT1 PLAU 2465/4885ALDH1A1 3323/4885KDM4E 1506/4885

“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.