SCHEMBL19919683

SCHEMBL19919683

N#Cc1cc(-n2c3ccccc3c3cc(-c4ccc(C(F)(F)F)cc4C(F)(F)F)ccc32)c(-c2ccncc2)cc1-n1c2ccccc2c2cc(-c3ccc(C(F)(F)F)cc3C(F)(F)F)ccc21

nearest known ligand 0.38

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
S1PR1 P21453 2/20 0.38
S1PR3 Q99500 2/20 0.38
AR P10275 4/20 0.37
ALOX5AP P20292 3/20 0.34
FEN1 P39748 2/20 0.34
CYP19A1 P11511 1/20 0.34
CYP11B1 P15538 1/20 0.34
CYP11B2 P19099 1/20 0.34
PDE10A Q9Y233 1/20 0.34
PGR P06401 1/20 0.33
XDH P47989 1/20 0.33
KIF11 P52732 1/20 0.32
METAP2 P50579 1/20 0.32
CYP2C9 P11712 1/20 0.32
SCN9A Q15858 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
SCHEMBL19919703 0.96 ALOX5AP (0.36) S1PR1S1PR3ARALOX5APFEN1
SCHEMBL19913119 0.95 S1PR1 (0.37) S1PR1S1PR3ARALOX5APFEN1
SCHEMBL19919459 0.94 S1PR1 (0.38) S1PR1S1PR3ARALOX5APFEN1
SCHEMBL19908957 0.94 S1PR1 (0.38) S1PR1S1PR3ARALOX5APFEN1
SCHEMBL20923172 0.94 S1PR1 (0.38) S1PR1S1PR3ARALOX5APFEN1
SCHEMBL21258680 0.92 AR (0.42) ARALOX5APFEN1PGRKIF11
SCHEMBL20924136 0.91 S1PR1 (0.42) S1PR1S1PR3ARALOX5APFEN1
SCHEMBL19919684 0.91 ALOX5AP (0.36) S1PR1S1PR3ARALOX5APFEN1
SCHEMBL19909072 0.91 ABCG2 (0.36) CYP19A1CYP11B1CYP11B2KIF11METAP2
SCHEMBL23912072 0.90 S1PR1 (0.39) S1PR1S1PR3ARALOX5APFEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11588114-B2 Organic molecules for use in optoelectronic devices SAMSUNG DISPLAY CO., LTD. (KR) 2023-02-21 US disclosed
US-20200212316-A1 ORGANIC MOLECULES FOR USE IN OPTOELECTRONIC DEVICES CYNORA GMBH (DE) 2020-07-02 US disclosed
US-10665792-B2 Organic molecules for use in optoelectronic devices CYNORA GMBH (DE) 2020-05-26 US disclosed
US-20180062085-A1 ORGANIC MOLECULES FOR USE IN 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 (3 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-20200212316-A1 ORGANIC MOLECULES FOR USE IN OPTOELECTRONIC DEVICES OR10J3, OPRM1, OR51E2 S1PR1 2957/4885S1PR3 1488/4885AR 4245/4885
US-10665792-B2 Organic molecules for use in optoelectronic devices OR10J3, CFD, AOX1 S1PR1 4351/4885S1PR3 3182/4885AR 4444/4885
US-11588114-B2 Organic molecules for use in optoelectronic devices OR10J3, OPRM1, OR51E2 S1PR1 2957/4885S1PR3 1488/4885AR 4245/4885

“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.