SCHEMBL21758693

SCHEMBL21758693

Cc1cc(C)cc(-c2ccc3c(c2)c2ccccc2n3-c2cnccc2-c2ccc(C#N)cc2-n2c3ccccc3c3cc(-c4cc(C)cc(C)c4)ccc32)c1

nearest known ligand 0.37

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
PTGER4 P35408 2/20 0.37
CYP11B2 P19099 4/20 0.37
CYP11B1 P15538 2/20 0.37
FLT3 P36888 7/20 0.36
CYP17A1 P05093 1/20 0.34
TNKS2 Q9H2K2 1/20 0.33
NPY5R Q15761 1/20 0.33
RORC P51449 1/20 0.32
GRM5 P41594 1/20 0.32
CNR2 P34972 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
SCHEMBL21758688 0.95 CYP11B2 (0.40) CYP11B2CYP11B1FLT3CYP17A1TNKS2
SCHEMBL21758184 0.94 PTGER4 (0.37) PTGER4CYP11B2CYP11B1FLT3CYP17A1
SCHEMBL21758552 0.93 CYP11B2 (0.39) PTGER4CYP11B2CYP11B1FLT3CYP17A1
SCHEMBL21758691 0.91 CYP11B2 (0.41) PTGER4CYP11B2CYP11B1FLT3CYP17A1
SCHEMBL21758698 0.91 CYP11B2 (0.36) PTGER4CYP11B2CYP11B1FLT3CYP17A1
SCHEMBL21758316 0.91 CYP11B2 (0.39) PTGER4CYP11B2CYP11B1FLT3CYP17A1
SCHEMBL21758152 0.90 CYP11B2 (0.39) PTGER4CYP11B2CYP11B1FLT3CYP17A1
SCHEMBL21758324 0.89 NEK1 (0.40) PTGER4CYP11B2CYP11B1FLT3CYP17A1
SCHEMBL21758722 0.89 CYP11B2 (0.40) CYP11B2CYP11B1FLT3CYP17A1TNKS2
SCHEMBL21758706 0.88 CYP11B2 (0.42) CYP11B2CYP11B1FLT3CYP17A1TNKS2

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-20200062734-A1 ORGANIC MOLECULES FOR USE IN ORGANIC OPTOELECTRONIC DEVICES SAMSUNG DISPLAY CO., LTD. (KR) 2020-02-27 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-20200062734-A1 ORGANIC MOLECULES FOR USE IN ORGANIC OPTOELECTRONIC DEVICES OXER1, OR10J3, OXGR1 PTGER4 1728/4885CYP11B2 1243/4885CYP11B1 1224/4885

“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.