SCHEMBL19919686

SCHEMBL19919686

N#Cc1cc(-n2c3ccc(-c4cc(C(F)(F)F)cc(C(F)(F)F)c4)cc3c3cc(-c4cc(C(F)(F)F)cc(C(F)(F)F)c4)ccc32)c(-c2ccncc2)cc1-n1c2ccc(-c3cc(C(F)(F)F)cc(C(F)(F)F)c3)cc2c2cc(-c3cc(C(F)(F)F)cc(C(F)(F)F)c3)ccc21

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP11B1 P15538 1/20 0.37
CYP11B2 P19099 1/20 0.37
S1PR1 P21453 2/20 0.36
S1PR3 Q99500 2/20 0.36
KIF11 P52732 1/20 0.35
METAP2 P50579 1/20 0.34
SQOR Q9Y6N5 1/20 0.33
XDH P47989 1/20 0.32
AAK1 Q2M2I8 3/20 0.32
GPBAR1 Q8TDU6 1/20 0.32
CHEK1 O14757 1/20 0.32
GSK3B P49841 1/20 0.32
MKNK1 Q9BUB5 1/20 0.32
BMP2K Q9NSY1 1/20 0.32
CTSS P25774 1/20 0.32
CTSK P43235 1/20 0.32
EPHX2 P34913 1/20 0.32
MAPK14 Q16539 1/20 0.32
RXRA P19793 1/20 0.31
RXRG P48443 1/20 0.31

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
SCHEMBL19919458 0.96 CYP11B1 (0.35) CYP11B1CYP11B2S1PR1S1PR3KIF11
SCHEMBL19913118 0.93 CYP11B1 (0.33) CYP11B1CYP11B2S1PR1S1PR3METAP2
SCHEMBL19908956 0.93 METAP2 (0.38) CYP11B1CYP11B2S1PR1S1PR3KIF11
SCHEMBL19919461 0.92 CYP11B1 (0.37) CYP11B1CYP11B2S1PR1S1PR3KIF11
SCHEMBL19917977 0.91 CYP11B1 (0.36) CYP11B1CYP11B2KIF11CTSSCTSK
SCHEMBL20923256 0.90 PIK3CA (0.37) CYP11B1CYP11B2METAP2XDHGPBAR1
SCHEMBL19919460 0.90 CYP11B1 (0.35) CYP11B1CYP11B2S1PR1S1PR3KIF11
SCHEMBL22170431 0.90 METAP2 (0.37) CYP11B1CYP11B2S1PR1S1PR3KIF11
SCHEMBL20923601 0.90 GPBAR1 (0.36) CYP11B1CYP11B2S1PR1S1PR3METAP2
SCHEMBL19913116 0.90 AR (0.33) CYP11B1CYP11B2METAP2SQORXDH

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 CYP11B1 610/4885CYP11B2 402/4885S1PR1 2957/4885
US-10665792-B2 Organic molecules for use in optoelectronic devices OR10J3, CFD, AOX1 CYP11B1 1400/4885CYP11B2 965/4885S1PR1 4351/4885
US-11588114-B2 Organic molecules for use in optoelectronic devices OR10J3, OPRM1, OR51E2 CYP11B1 610/4885CYP11B2 402/4885S1PR1 2957/4885

“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.