SCHEMBL19912366

SCHEMBL19912366

Cc1cc(-c2cc(F)c(C#N)cc2F)cc(C(F)(F)F)c1

nearest known ligand 0.44

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
CYP11B1 P15538 3/20 0.42
CYP11B2 P19099 3/20 0.42
TRPV4 Q9HBA0 1/20 0.41
AR P10275 6/20 0.38
NOTUM Q6P988 1/20 0.36
ALOX5AP P20292 1/20 0.34
FEN1 P39748 1/20 0.34
ESR1 P03372 1/20 0.34
ESR2 Q92731 1/20 0.34
AKR1C3 P42330 1/20 0.33
AKR1C2 P52895 1/20 0.33
EGLN2 Q96KS0 3/20 0.32
CTSS P25774 1/20 0.32
CTSK P43235 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
SCHEMBL19903442 0.89 TRPV4 (0.47) CYP11B1CYP11B2TRPV4ARALOX5AP
SCHEMBL19903598 0.78 CYP11B1 (0.44) CYP11B1CYP11B2TRPV4ARALOX5AP
SCHEMBL19912364 0.75 TRPV4 (0.40) CYP11B1CYP11B2TRPV4ARNOTUM
SCHEMBL18882662 0.73 AR (0.40) CYP11B1CYP11B2TRPV4AR
SCHEMBL22822524 0.73 RXRA (0.44) CYP11B1CYP11B2TRPV4ARALOX5AP
SCHEMBL19912365 0.73 NOTUM (0.40) CYP11B1CYP11B2ARNOTUMEGLN2
SCHEMBL14134208 0.72 AR (0.41) ARNOTUMCTSSCTSK
SCHEMBL25658474 0.71 ALOX5AP (0.50) CYP11B1CYP11B2TRPV4ARALOX5AP
SCHEMBL20444106 0.71 TRPV4 (0.60) CYP11B1CYP11B2TRPV4ESR1ESR2
SCHEMBL14133906 0.71 RXRA (0.36) ARNOTUMCTSSCTSK

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-20180062086-A1 ORGANIC MOLECULES, ESPECIALLY FOR USE IN ORGANIC OPTOELECTRONIC DEVICES SAMSUNG DISPLAY CO., LTD. (KR) 2018-03-01 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-20180062086-A1 ORGANIC MOLECULES, ESPECIALLY FOR USE IN ORGANIC OPTOELECTRONIC DEVICES OR10J3, ORC3, AOC3 CYP11B1 823/4885CYP11B2 550/4885TRPV4 1280/4885

“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.