SCHEMBL21365083

SCHEMBL21365083

Cc1ccc2c(c1)c1ccccc1n2-c1ccc(-c2nc(-c3ccccc3)nc(-c3ccccc3)n2)cc1-c1ccc(-n2c3ccccc3c3cc(C)ccc32)c(-c2ccc(C#N)cc2)c1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ABCG2 Q9UNQ0 8/20 0.38
PTGER4 P35408 1/20 0.38
MEN1 O00255 3/20 0.38
KMT2A Q03164 3/20 0.38
CYP1A2 P05177 3/20 0.38
CYP3A4 P08684 3/20 0.38
ALDH1A1 P00352 2/20 0.38
CYP2C19 P33261 2/20 0.38
CLK4 Q9HAZ1 2/20 0.38
CYP2D6 P10635 2/20 0.38
TSHR P16473 2/20 0.38
LMNA P02545 1/20 0.38
CYP2C9 P11712 1/20 0.38
HSD17B10 Q99714 1/20 0.38
ABCB1 P08183 4/20 0.37
GRM2 Q14416 1/20 0.36
MAPK1 P28482 1/20 0.35
KDM4E B2RXH2 1/20 0.35
HPGD P15428 1/20 0.35
PPARG P37231 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
SCHEMBL27016111 0.95 ABCG2 (0.36) ABCG2PTGER4MEN1KMT2ACYP1A2
SCHEMBL21364325 0.95 ABCG2 (0.39) ABCG2PTGER4MEN1KMT2ACYP1A2
SCHEMBL21364327 0.94 ABCG2 (0.37) ABCG2PTGER4MEN1KMT2ACYP1A2
SCHEMBL22243136 0.94 CYP1A2 (0.41) ABCG2PTGER4MEN1KMT2ACYP1A2
SCHEMBL27016112 0.93 ABCG2 (0.38) ABCG2MEN1KMT2ACYP1A2CYP3A4
SCHEMBL21364790 0.93 CYP1A2 (0.46) ABCG2MEN1KMT2ACYP1A2CYP3A4
SCHEMBL21365090 0.93 ABCG2 (0.40) ABCG2PTGER4MEN1KMT2ACYP1A2
SCHEMBL21365089 0.92 CYP1A2 (0.40) ABCG2PTGER4MEN1KMT2ACYP1A2
SCHEMBL21364340 0.92 ABCG2 (0.41) ABCG2MEN1KMT2ACYP1A2CYP3A4
SCHEMBL21364348 0.91 ABCG2 (0.39) ABCG2MEN1KMT2ACYP1A2CYP3A4

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-11161836-B2 Organic molecules for optoelectronic devices CYNORA GMBH (DE) 2021-11-02 US disclosed
US-20190284174-A1 ORGANIC MOLECULES FOR OPTOELECTRONIC DEVICES SAMSUNG DISPLAY CO., LTD. (KR) 2019-09-19 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-20190284174-A1 ORGANIC MOLECULES FOR OPTOELECTRONIC DEVICES OR10J3, OR51E2, OCIAD2 ABCG2 3275/4885PTGER4 1462/4885MEN1 1332/4885
US-11161836-B2 Organic molecules for optoelectronic devices OR10J3, OR51E2, OCIAD2 ABCG2 3275/4885PTGER4 1462/4885MEN1 1332/4885

“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.