SCHEMBL29831737

SCHEMBL29831737

O=c1ccc2cnnnc2o1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MCL1 Q07820 6/20 0.38
CA12 O43570 5/20 0.38
CA9 Q16790 5/20 0.38
LMNA P02545 4/20 0.38
TDP1 Q9NUW8 4/20 0.38
CA1 P00915 3/20 0.38
CA3 P07451 2/20 0.38
CA4 P22748 2/20 0.38
CA6 P23280 2/20 0.38
CA5A P35218 2/20 0.38
CA7 P43166 2/20 0.38
CA14 Q9ULX7 2/20 0.38
CA2 P00918 1/20 0.38
SOST Q9BQB4 1/20 0.38
CA5B Q9Y2D0 1/20 0.38
CYP19A1 P11511 3/20 0.37
ALDH1A1 P00352 6/20 0.34
HSD17B10 Q99714 6/20 0.34
KDM4E B2RXH2 5/20 0.34
HPGD P15428 5/20 0.34

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
SCHEMBL3612033 0.70
SCHEMBL29557070 0.69 EGFR (0.36) MCL1CA12CA9LMNATDP1
SCHEMBL19641416 0.69 EGFR (0.36) MCL1CA12CA9LMNATDP1
SCHEMBL23877680 0.67 GLA (0.33) MCL1CA12CA9LMNATDP1
SCHEMBL19661702 0.64 MEN1 (0.36) MCL1CA12CA9LMNATDP1
SCHEMBL3860414 0.64 NOS1 (0.48) MCL1CA12CA9LMNATDP1
SCHEMBL1404660 0.62 LMNA (0.47) MCL1CA12CA9LMNATDP1
SCHEMBL9182515 0.62 CA12 (0.38) MCL1CA12CA9LMNATDP1
Hydrochloric Acid SCHEMBL15228365 0.61 LMNA (0.45) MCL1CA12CA9LMNATDP1
SCHEMBL4302172 0.61 CCR1 (0.48) MCL1CA12CA9LMNATDP1

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-20220251109-A1 OXAAZAQUINAZOLINE-7(8H)-KETONE COMPOUND, PREPARATION METHOD THEREFOR AND PHARMACEUTICAL APPLICATION THEREOF GENFLEET THERAPEUTICS (SHANGHAI) INC. (CN) 2022-08-11 US claimed
CN-113767106-B Oxazaquinazolin-7 (8H) -ones, preparation method and medical application thereof 劲方医药科技(上海)有限公司 2024-02-20 CN disclosed
US-20220251109-A1 OXAAZAQUINAZOLINE-7(8H)-KETONE COMPOUND, PREPARATION METHOD THEREFOR AND PHARMACEUTICAL APPLICATION THEREOF GENFLEET THERAPEUTICS (SHANGHAI) INC. (CN) 2022-08-11 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-20220251109-A1 OXAAZAQUINAZOLINE-7(8H)-KETONE COMPOUND, PREPARATION METHOD THEREFOR AND PHARMACEUTICAL APPLICATION THEREOF KRAS, NRAS, WEE1 MCL1 428/4885CA12 3598/4885CA9 2220/4885

“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.