SCHEMBL8978641

SCHEMBL8978641

Oc1ccc(-c2csc(-c3cccnc3)n2)cc1

nearest known ligand 0.89

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CYP19A1 P11511 9/20 0.89
RAB9A P51151 5/20 0.77
KDM4E B2RXH2 3/20 0.77
ALDH1A1 P00352 1/20 0.77
AXL P30530 1/20 0.77
PBRM1 Q86U86 1/20 0.77
MKNK1 Q9BUB5 1/20 0.77
MKNK2 Q9HBH9 1/20 0.77
MAPT P10636 2/20 0.72
MAPK1 P28482 2/20 0.72
GAA P10253 1/20 0.72
TDP1 Q9NUW8 1/20 0.72
NPC1 O15118 4/20 0.71
HPGDS O60760 1/20 0.62
HSD17B10 Q99714 1/20 0.61

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
SCHEMBL11460926 0.88 RAB9A (0.94) CYP19A1RAB9AKDM4EALDH1A1AXL
SCHEMBL7495850 0.87 RAB9A (1.00) CYP19A1RAB9AKDM4EALDH1A1AXL
SCHEMBL6649362 0.87 CYP19A1 (0.87) CYP19A1RAB9AKDM4EALDH1A1AXL
SCHEMBL6196239 0.87 CYP19A1 (1.00) CYP19A1RAB9AKDM4EALDH1A1AXL
Hydrochloric Acid SCHEMBL11452940 0.86 RAB9A (0.97) CYP19A1RAB9AKDM4EALDH1A1AXL
SCHEMBL8052755 0.85 HSD17B1 (0.75) CYP19A1RAB9AKDM4EALDH1A1AXL
SCHEMBL11473901 0.85 RAB9A (0.77) CYP19A1RAB9AKDM4EALDH1A1AXL
SCHEMBL11359373 0.85 CYP19A1 (0.89) CYP19A1RAB9AKDM4EALDH1A1AXL
SCHEMBL14320817 0.85 RAB9A (0.77) CYP19A1RAB9AKDM4EALDH1A1AXL
SCHEMBL13779291 0.84 MAPT (1.00) CYP19A1RAB9AKDM4EALDH1A1AXL

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
EP-0384271-B1 Method for enhancement of chemiluminescence WAKO PURE CHEM IND LTD (JP) 1996-05-08 EP claimed
US-5106732-A Using oxazole or thiazole derivative TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1992-04-21 US claimed
EP-0384271-A2 Method for enhancement of chemiluminescence WAKO PURE CHEMICAL INDUSTRIES LTD (JP) 1990-08-29 EP claimed
CN-119930600-A Preparation method of novel sulfonate substance and application of novel sulfonate substance in bacteriostasis and plant growth promotion of composition 贵州工业职业技术学院 2025-05-06 CN disclosed
US-20210246109-A1 POTENT AND SELECTIVE INHIBITORS OF CYTOCHROME P450 UNIVERSITY OF KENTUCKY RESEARCH FOUNDATION 2021-08-12 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-20210246109-A1 POTENT AND SELECTIVE INHIBITORS OF CYTOCHROME P450 CYP11B1, CYP1B1, CYP27A1 CYP19A1 11/4885RAB9A 1418/4885KDM4E 3500/4885

“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.