SCHEMBL21928591

SCHEMBL21928591

Cc1ccc(-c2ccc3c(c2)c2cc(-c4ccc(C)cc4C)ccc2n3-c2cncc(-n3c4ccc(-c5ccc(C)cc5C)cc4c4cc(-c5ccc(C)cc5C)ccc43)c2-c2ccc(C#N)cc2)c(C)c1

nearest known ligand 0.39

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
CYP11B2 P19099 6/20 0.39
CYP11B1 P15538 4/20 0.39
CHEK1 O14757 1/20 0.36
AR P10275 1/20 0.35
KDM1A O60341 9/20 0.35
GRM2 Q14416 1/20 0.34
PRKCQ Q04759 1/20 0.33
NSD2 O96028 1/20 0.33

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
SCHEMBL21928615 0.95 PTGER4 (0.38) CYP11B2CYP11B1CHEK1ARKDM1A
SCHEMBL21928593 0.91 CHEK1 (0.40) CYP11B2CYP11B1CHEK1ARKDM1A
SCHEMBL24737201 0.90 CYP1A2 (0.38) CYP11B2CYP11B1
SCHEMBL25658989 0.90 ALDH1A1 (0.35) CYP11B2CYP11B1CHEK1KDM1AGRM2
SCHEMBL24737209 0.90 AR (0.40) CYP11B2CYP11B1CHEK1ARKDM1A
SCHEMBL21928418 0.89 CHEK1 (0.37) CYP11B2CYP11B1CHEK1ARKDM1A
SCHEMBL21929292 0.89 CHEK1 (0.38) CYP11B2CYP11B1CHEK1ARKDM1A
SCHEMBL21929268 0.88 CYP11B2 (0.41) CYP11B2CYP11B1CHEK1AR
SCHEMBL21928614 0.87 MAPKAPK2 (0.42) CYP11B2CYP11B1CHEK1ARKDM1A
SCHEMBL21928373 0.87 CYP1A2 (0.36) CYP11B2CYP11B1

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-20220388960-A1 ORGANIC MOLECULES FOR USE IN LIGHT-EMITTING DEVICES CYNORA GMBH (DE) 2022-12-08 US disclosed
US-20200136054-A1 ORGANIC MOLECULES FOR USE IN ORGANIC OPTOELECTRONIC DEVICES SAMSUNG DISPLAY CO., LTD. (KR) 2020-04-30 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-20200136054-A1 ORGANIC MOLECULES FOR USE IN ORGANIC OPTOELECTRONIC DEVICES OR10J3, OGFR, OR51E2 CYP11B2 902/4885CYP11B1 1431/4885CHEK1 3808/4885
US-20220388960-A1 ORGANIC MOLECULES FOR USE IN LIGHT-EMITTING DEVICES ALDH1A2, AOX1, CYBA CYP11B2 163/4885CYP11B1 432/4885CHEK1 1237/4885

“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.