SCHEMBL22343385

SCHEMBL22343385

COc1cccc(CNc2nc(NCc3ccco3)c3ccccc3n2)c1

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 6/20 0.67
MEN1 O00255 3/20 0.67
BLM P54132 1/20 0.67
APP P05067 1/20 0.64
MAPT P10636 8/20 0.62
MAPK1 P28482 7/20 0.62
KDM4E B2RXH2 7/20 0.62
NPSR1 Q6W5P4 5/20 0.62
RECQL P46063 1/20 0.62
SOS1 Q07889 3/20 0.60
LMNA P02545 6/20 0.59
ALDH1A1 P00352 5/20 0.59
SMN1; SMN2 Q16637 4/20 0.59
HPGD P15428 3/20 0.59
USP2 O75604 2/20 0.59
NR2F2 P24468 1/20 0.59
CYP1A2 P05177 1/20 0.57
CYP3A4 P08684 1/20 0.57
CYP2D6 P10635 1/20 0.57
CYP2C9 P11712 1/20 0.57

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
SCHEMBL29490079 1.00 KMT2A (0.67) KMT2AMEN1BLMAPPMAPT
SCHEMBL2587104 0.88 APP (0.76) KMT2AMEN1APPMAPTMAPK1
SCHEMBL30455311 0.83 MAPT (0.81) KMT2AMEN1BLMMAPTMAPK1
SCHEMBL23747980 0.81 HTT (0.72) KMT2AMEN1APPMAPTMAPK1
SCHEMBL30125191 0.81 HTT (0.72) KMT2AMEN1APPMAPTMAPK1
SCHEMBL30455471 0.80 MAPT (0.72) KMT2AMEN1BLMAPPMAPT
SCHEMBL4867976 0.79 APP (0.76) KMT2AMEN1APPMAPTMAPK1
SCHEMBL22342962 0.78 CTNNB1 (0.77) KMT2AMEN1BLMAPPMAPT
SCHEMBL29490089 0.78 CTNNB1 (0.77) KMT2AMEN1BLMAPPMAPT
SCHEMBL3108468 0.78 APP (0.74) KMT2AMEN1APPMAPTMAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11318137-B2 Quinazoline compounds as modulators of Ras signaling VANDERBILT UNIVERSITY (US) 2022-05-03 US disclosed
US-20200253974-A1 QUINAZOLINE COMPOUNDS AS MODULATORS OF RAS SIGNALING VANDERBILT UNIVERSITY 2020-08-13 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 (2 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-20200253974-A1 QUINAZOLINE COMPOUNDS AS MODULATORS OF RAS SIGNALING NRAS, KRAS, MAVS KMT2A 3348/4885MEN1 851/4885BLM 2117/4885
US-11318137-B2 Quinazoline compounds as modulators of Ras signaling NRAS, KRAS, MAVS KMT2A 3348/4885MEN1 851/4885BLM 2117/4885

“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.