SCHEMBL9817824

SCHEMBL9817824

COc1cc2nc(C)[nH]c(=O)c2cc1C

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.59
HSD17B10 Q99714 2/20 0.59
LMNA P02545 1/20 0.59
GAA P10253 2/20 0.55
SMN1; SMN2 Q16637 2/20 0.55
NPC1 O15118 1/20 0.55
USP2 O75604 1/20 0.55
ALDH1A1 P00352 1/20 0.55
GLA P06280 1/20 0.55
MAPT P10636 1/20 0.55
HPGD P15428 1/20 0.55
RAB9A P51151 1/20 0.55
TRPV1 Q8NER1 3/20 0.50
PDE3B Q13370 2/20 0.50
PDE3A Q14432 2/20 0.50
PARP1 P09874 3/20 0.49
TNKS2 Q9H2K2 1/20 0.47
MEN1 O00255 2/20 0.46
KMT2A Q03164 2/20 0.46
POLB P06746 2/20 0.46

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
SCHEMBL20511734 0.94 KDM4E (0.59) KDM4EHSD17B10LMNAGAASMN1; SMN2
SCHEMBL6128121 0.90 KDM4E (0.62) KDM4EHSD17B10LMNAGAASMN1; SMN2
SCHEMBL20327078 0.84 KDM4E (0.56) KDM4EHSD17B10LMNAGAASMN1; SMN2
SCHEMBL29663464 0.84 KDM4E (0.56) KDM4EHSD17B10LMNAGAASMN1; SMN2
SCHEMBL20327602 0.84 KDM4E (0.56) KDM4EHSD17B10LMNAGAASMN1; SMN2
SCHEMBL23520600 0.84 KDM4E (0.56) KDM4EHSD17B10LMNAGAASMN1; SMN2
SCHEMBL8529995 0.83 KDM4E (0.66) KDM4EHSD17B10LMNAGAASMN1; SMN2
SCHEMBL23520715 0.81 KDM4E (0.56) KDM4EHSD17B10LMNAGAASMN1; SMN2
SCHEMBL23555542 0.81 KDM4E (0.56) KDM4EHSD17B10LMNAGAASMN1; SMN2
SCHEMBL27041249 0.81 KDM4E (0.56) KDM4EHSD17B10LMNAGAASMN1; SMN2

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
WO-2022148442-A1 6-SUBSTITUTED PHOSPHORYL QUINAZOLINE DERIVATIVE, PREPARATION METHOD THEREFOR AND USE THEREOF 武汉人福创新药物研发中心有限公司 2022-07-14 WO disclosed
US-20210177851-A1 NOVEL BENZYLAMINO SUBSTITUTED QUINAZOLINES AND DERIVATIVES AS SOS1 INHIBITORS BOEHRINGER INGELHEIM INT (DE) 2021-06-17 US disclosed
US-4981856-A QUINAZOLINE IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1991-01-01 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-20210177851-A1 NOVEL BENZYLAMINO SUBSTITUTED QUINAZOLINES AND DERIVATIVES AS SOS1 INHIBITORS SOS1, SOS2, SOST KDM4E 3689/4885HSD17B10 4752/4885LMNA 2712/4885

“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.