SCHEMBL19918033

SCHEMBL19918033

Cc1cc(-c2cc(-n3c4ccccc4c4cc(-c5cc(C#N)cc(C#N)c5)ccc43)c(-n3c4ccccc4c4cc(-c5cc(C#N)cc(C#N)c5)ccc43)cc2C#N)cc(C(F)(F)F)c1

nearest known ligand 0.35

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
RXRA P19793 1/20 0.35
RXRG P48443 1/20 0.35
AR P10275 3/20 0.34
PTGER4 P35408 1/20 0.32
SYK P43405 1/20 0.32
MAT2A P31153 1/20 0.31
XDH P47989 2/20 0.31
GRM5 P41594 2/20 0.30
APP P05067 1/20 0.30
BACE1 P56817 1/20 0.30
GPBAR1 Q8TDU6 1/20 0.30

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
SCHEMBL19918023 0.94 AR (0.36) RXRAARPTGER4XDH
SCHEMBL20617112 0.94 RXRA (0.39) RXRARXRGARPTGER4XDH
SCHEMBL21440727 0.94 MAT2A (0.38) ARPTGER4SYKMAT2AXDH
SCHEMBL19903693 0.93 RXRA (0.38) RXRARXRGARPTGER4XDH
SCHEMBL22822318 0.93 AR (0.43) RXRARXRGARPTGER4SYK
SCHEMBL22822156 0.93 AR (0.39) RXRARXRGARPTGER4XDH
SCHEMBL19917942 0.93 AR (0.36) RXRAARPTGER4XDH
SCHEMBL22822572 0.93 RXRA (0.39) RXRARXRGARSYKXDH
SCHEMBL22822680 0.93 RXRA (0.39) RXRARXRGARPTGER4XDH
SCHEMBL22822449 0.92 RXRA (0.36) RXRARXRGARSYKXDH

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 2 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
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 (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 RXRA 3779/4885RXRG 3669/4885AR 4190/4885
US-20180062086-A1 ORGANIC MOLECULES, ESPECIALLY FOR USE IN ORGANIC OPTOELECTRONIC DEVICES OR10J3, ORC3, AOC3 RXRA 3635/4885RXRG 3474/4885AR 4212/4885

“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.