SCHEMBL21546985

SCHEMBL21546985

Cc1ccc(-c2ccc3c4ccc(-c5ccc(C)cc5C)cc4n(-c4cc(C#N)cc(-n5c6cc(-c7ccc(C)cc7C)ccc6c6ccc(-c7ccc(C)cc7C)cc65)c4-c4cccc(C#N)c4)c3c2)c(C)c1

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ELANE P08246 1/20 0.35
PRF1 P14222 1/20 0.34
BRD4 O60885 1/20 0.34
PGR P06401 2/20 0.34
KDM4E B2RXH2 3/20 0.33
CYP1A2 P05177 3/20 0.33
CYP3A4 P08684 2/20 0.33
CYP2D6 P10635 2/20 0.33
CYP2C19 P33261 2/20 0.33
AR P10275 1/20 0.33
GRIN1 Q05586 1/20 0.33
GRIN2B Q13224 1/20 0.33
HPGD P15428 2/20 0.32
TSHR P16473 2/20 0.32
MAPK1 P28482 2/20 0.32
HSD17B10 Q99714 2/20 0.32
ALDH1A1 P00352 1/20 0.32
LMNA P02545 1/20 0.32
TP53 P04637 1/20 0.32
CYP2C9 P11712 1/20 0.32

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
SCHEMBL21546480 0.96 ELANE (0.35) ELANEPRF1BRD4PGRKDM4E
SCHEMBL21546982 0.92 ELANE (0.36) ELANEPRF1BRD4PGRKDM4E
SCHEMBL21414255 0.91 ALDH1A1 (0.32) ALDH1A1CHEK1
SCHEMBL21546947 0.91 ELANE (0.36) ELANEPRF1BRD4PGRKDM4E
SCHEMBL24737200 0.91 CYP1A2 (0.38) ELANEKDM4ECYP1A2CYP3A4CYP2D6
SCHEMBL21546711 0.90 MAT2A (0.38) ELANEPRF1ARGRIN1GRIN2B
SCHEMBL21546704 0.89 ADRA2C (0.38) PRF1BRD4PGRARTGFBR1
SCHEMBL21546943 0.89 TGFBR1 (0.34) PGRCYP1A2CYP3A4ARALDH1A1
SCHEMBL21546695 0.89 CLK4 (0.37) ELANEBRD4KDM4ECYP1A2CYP3A4
SCHEMBL21414104 0.88 PDE9A (0.35) LMNATP53

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
US-10981930-B2 Organic molecules for use in optoelectronic devices CYNORA GMBH (DE) 2021-04-20 US disclosed
US-20200385399-A1 ORGANIC MOLECULES FOR USE IN OPTOELECTRONIC DEVICES SAMSUNG DISPLAY CO., LTD. (KR) 2020-12-10 US disclosed
EP-3478793-B1 ORGANIC MOLECULES, IN PARTICULAR FOR USE IN OPTOELECTRONIC DEVICES CYNORA GMBH (DE) 2019-11-06 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 (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-10981930-B2 Organic molecules for use in optoelectronic devices OR10J3, OR51E2, EPCAM ELANE 2057/4885PRF1 4364/4885BRD4 2909/4885
US-20200385399-A1 ORGANIC MOLECULES FOR USE IN OPTOELECTRONIC DEVICES OR10J3, OR51E2, EPCAM ELANE 2057/4885PRF1 4364/4885BRD4 2909/4885

“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.