SCHEMBL21742779

SCHEMBL21742779

Cc1cccc2c1c1cc(-c3nc(-c4ccccc4)nc(-c4ccccc4)n3)ccc1n2-c1ccccc1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.39
KDM4E B2RXH2 2/20 0.39
ATM Q13315 1/20 0.39
AVPR1A P37288 1/20 0.38
RXFP1 Q9HBX9 1/20 0.38
LMNA P02545 2/20 0.38
PTGER4 P35408 2/20 0.38
MEN1 O00255 1/20 0.38
NPC1 O15118 1/20 0.38
RAB9A P51151 1/20 0.38
KMT2A Q03164 1/20 0.38
MAPK1 P28482 2/20 0.36
RXRA P19793 1/20 0.36
HTT P42858 1/20 0.36
TSHR P16473 2/20 0.36
HSD17B10 Q99714 2/20 0.36
MAPT P10636 1/20 0.36
JAK2 O60674 1/20 0.36
JAK3 P52333 1/20 0.36
ALDH1A1 P00352 1/20 0.35

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
SCHEMBL19933748 0.88 KDM4E (0.40) L3MBTL1KDM4EATMRXFP1LMNA
SCHEMBL19011136 0.88 L3MBTL1 (0.44) L3MBTL1KDM4EATMAVPR1ARXFP1
SCHEMBL21742841 0.87 KDM4E (0.39) L3MBTL1KDM4EATMAVPR1ARXFP1
SCHEMBL18126018 0.87 L3MBTL1 (0.47) L3MBTL1KDM4EATMAVPR1ARXFP1
SCHEMBL14900744 0.86 KDM4E (0.46) L3MBTL1KDM4EATMAVPR1ARXFP1
SCHEMBL16997276 0.85 AVPR1A (0.36) L3MBTL1KDM4EATMAVPR1ARXFP1
SCHEMBL18730514 0.85 CD274 (0.34) L3MBTL1KDM4EATMAVPR1ARXFP1
SCHEMBL19011150 0.84 KDM4E (0.51) L3MBTL1KDM4EATMRXFP1LMNA
SCHEMBL22479865 0.84 KDM4E (0.41) L3MBTL1KDM4EATMAVPR1ARXFP1
SCHEMBL19039231 0.84 KDM4E (0.38) L3MBTL1KDM4EATMAVPR1ARXFP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20200055822-A1 MATERIALS FOR ORGANIC ELECTRONIC DEVICES MERCK PATENT GMBH (DE) 2020-02-20 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-20200055822-A1 MATERIALS FOR ORGANIC ELECTRONIC DEVICES PNMT, DDT, TYR L3MBTL1 2878/4885KDM4E 3201/4885ATM 1504/4885

“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.