SCHEMBL19918017

SCHEMBL19918017

Cc1cc(C)cc(-c2ccc3c(c2)c2cc(-c4cc(C)cc(C)c4)ccc2n3-c2cc(-c3cc(C(F)(F)F)cc(C(F)(F)F)c3)cc(-n3c4ccc(-c5cc(C)cc(C)c5)cc4c4cc(-c5cc(C)cc(C)c5)ccc43)c2C#N)c1

nearest known ligand 0.35

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
RXRA P19793 4/20 0.35
RXRB P28702 3/20 0.35
ICMT O60725 6/20 0.35
AR P10275 2/20 0.34
RXRG P48443 3/20 0.34
NAAA Q02083 1/20 0.32
ALDH1A1 P00352 1/20 0.32
GLA P06280 1/20 0.32
GAA P10253 1/20 0.32
HPGD P15428 1/20 0.32
ATM Q13315 1/20 0.32
POLB P06746 1/20 0.32
KDM5B Q9UGL1 1/20 0.31
CYP11B2 P19099 2/20 0.31
CYP11B1 P15538 1/20 0.31
KIF11 P52732 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
SCHEMBL19912559 0.99 RXRA (0.34) RXRARXRBICMTARRXRG
SCHEMBL19912547 0.98 AR (0.34) RXRARXRBICMTARRXRG
SCHEMBL19917819 0.94 AR (0.34) RXRARXRBICMTARRXRG
SCHEMBL22822427 0.94 RXRA (0.41) RXRARXRBICMTARRXRG
SCHEMBL19912541 0.93 AR (0.40) RXRARXRBICMTARRXRG
SCHEMBL19917944 0.93 AR (0.42) RXRARXRBICMTARRXRG
SCHEMBL19903552 0.93 RXRA (0.38) RXRARXRBICMTRXRGNAAA
SCHEMBL19912546 0.92 AR (0.34) RXRARXRBICMTARRXRG
SCHEMBL19913192 0.92 KIF11 (0.35) RXRARXRBICMTARRXRG
SCHEMBL19913320 0.91 ICMT (0.32) RXRARXRBICMTARRXRG

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 3779/4885RXRB 3839/4885ICMT 156/4885
US-20180062086-A1 ORGANIC MOLECULES, ESPECIALLY FOR USE IN ORGANIC OPTOELECTRONIC DEVICES OR10J3, ORC3, AOC3 RXRA 3635/4885RXRB 3722/4885ICMT 127/4885

“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.