SCHEMBL19903598

SCHEMBL19903598

N#Cc1cc(F)c(F)cc1-c1cc(C(F)(F)F)cc(C(F)(F)F)c1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP11B1 P15538 1/20 0.44
CYP11B2 P19099 1/20 0.44
TRPV4 Q9HBA0 1/20 0.40
ALOX5AP P20292 1/20 0.39
FEN1 P39748 1/20 0.39
CTSS P25774 2/20 0.36
CTSK P43235 1/20 0.36
AKR1C3 P42330 2/20 0.35
AKR1C2 P52895 2/20 0.35
AKR1C1 Q04828 1/20 0.35
KIF11 P52732 3/20 0.35
AR P10275 3/20 0.35
GCGR P47871 1/20 0.35
CES2 O00748 1/20 0.34
NAAA Q02083 1/20 0.33
ABL1 P00519 1/20 0.33
RXRA P19793 1/20 0.33
RXRG P48443 1/20 0.33
ESR1 P03372 1/20 0.33
ESR2 Q92731 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
SCHEMBL22822524 0.90 RXRA (0.44) CYP11B1CYP11B2TRPV4ALOX5APFEN1
SCHEMBL19903442 0.88 TRPV4 (0.47) CYP11B1CYP11B2TRPV4ALOX5APFEN1
SCHEMBL19912366 0.78 CYP11B1 (0.42) CYP11B1CYP11B2TRPV4ALOX5APFEN1
SCHEMBL25658482 0.77 ALOX5AP (0.49) CYP11B1CYP11B2TRPV4ALOX5APFEN1
SCHEMBL20444104 0.76 TRPV4 (0.50) CYP11B1CYP11B2TRPV4ABL1ESR1
SCHEMBL19903462 0.75 CYP11B1 (0.48) CYP11B1CYP11B2TRPV4ALOX5APFEN1
SCHEMBL23969036 0.74 CYP11B1 (0.33) CYP11B1CYP11B2ALOX5APFEN1CTSS
SCHEMBL3593310 0.74 CES2 (0.37) CYP11B1CYP11B2CTSSCTSKAKR1C3
SCHEMBL20111535 0.73 AR (0.46) CYP11B1CYP11B2ALOX5APFEN1AR
SCHEMBL25983848 0.73 CYP11B1 (0.41) CYP11B1CYP11B2CTSSCTSKKIF11

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10439151-B2 Organic molecules, especially for use in organic optoelectronic devices CYNORA GMBH (DE) 2019-10-08 US disclosed
EP-3360945-B1 ORGANIC ELECTROLUMINESCENT DEVICE CYNORA GMBH (DE) 2019-04-24 EP disclosed
EP-3287450-B1 ORGANIC MOLECULES, IN PARTICULAR FOR USE IN ORGANIC OPTOELECTRONIC DEVICES CYNORA GMBH (DE) 2019-03-20 EP disclosed
US-20180062086-A1 ORGANIC MOLECULES, ESPECIALLY FOR USE IN ORGANIC OPTOELECTRONIC DEVICES SAMSUNG DISPLAY CO., LTD. (KR) 2018-03-01 US disclosed
EP-3287450-A1 ORGANIC MOLECULES, IN PARTICULAR FOR USE IN ORGANIC OPTOELECTRONIC DEVICES CYNORA GMBH (DE) 2018-02-28 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-10439151-B2 Organic molecules, especially for use in organic optoelectronic devices OR10J3, ORC3, AOC3 CYP11B1 877/4885CYP11B2 601/4885TRPV4 1310/4885
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.