SCHEMBL25430396

SCHEMBL25430396

COc1cc2c(NCCN(C)C)nc(N3CCCN(C)CC3)nc2cc1C#CCCN1CCCC1.COc1cc2c(NCCN(C)C)nc(N3CCCN(C)CC3)nc2cc1C#CCCN1CCCC1

nearest known ligand 0.62

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
EHMT2 Q96KQ7 9/20 0.62
EHMT1 Q9H9B1 8/20 0.62
KMT5A Q9NQR1 10/20 0.57
WHR1 P49842 1/20 0.53

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
SCHEMBL25359230 1.00 EHMT2 (0.62) EHMT2EHMT1KMT5AWHR1
SCHEMBL30546999 1.00 EHMT2 (0.62) EHMT2EHMT1KMT5AWHR1
SCHEMBL25362090 0.95 KMT5A (0.63) EHMT2EHMT1KMT5AWHR1
SCHEMBL30547005 0.95 KMT5A (0.63) EHMT2EHMT1KMT5AWHR1
SCHEMBL26639341 0.95 KMT5A (0.63) EHMT2EHMT1KMT5AWHR1
SCHEMBL25431583 0.88 KMT5A (0.67) EHMT2EHMT1KMT5AWHR1
SCHEMBL25363099 0.88 KMT5A (0.67) EHMT2EHMT1KMT5AWHR1
SCHEMBL25432549 0.88 KMT5A (0.64) EHMT2EHMT1KMT5AWHR1
SCHEMBL25361574 0.88 KMT5A (0.64) EHMT2EHMT1KMT5AWHR1
SCHEMBL25361457 0.87 KMT5A (0.53) EHMT2EHMT1KMT5AWHR1

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-20230365530-A1 QUINAZOLINE-2,4-DIAMINE DERIVATIVE AND PHARMACEUTICAL COMPOSITION FOR PREVENTING OR TREATING CANCER COMPRISING SAME AS ACTIVE INGREDIENT OMIC SMAP INC. (KR) 2023-11-16 US disclosed
EP-4230624-A1 QUINAZOLINE-2,4-DIAMINE DERIVATIVE AND PHARMACEUTICAL COMPOSITION FOR PREVENTING OR TREATING CANCER COMPRISING SAME AS ACTIVE INGREDIENT The Asan Foundation (KR) 2023-08-23 EP 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-20230365530-A1 QUINAZOLINE-2,4-DIAMINE DERIVATIVE AND PHARMACEUTICAL COMPOSITION FOR PREVENTING OR TREATING CANCER COMPRISING SAME AS ACTIVE INGREDIENT EHMT2, EHMT1, HNMT EHMT2 1/4885EHMT1 2/4885KMT5A 5/4885

“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.