SCHEMBL19912534

SCHEMBL19912534

Cc1cccc(-c2ccc3c(c2)c2cc(-c4cccc(C)c4)ccc2n3-c2cc(-c3cc(C)cc(C(F)(F)F)c3)cc(-n3c4ccc(-c5cccc(C)c5)cc4c4cc(-c5cccc(C)c5)ccc43)c2C#N)c1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AR P10275 2/20 0.44
ICMT O60725 2/20 0.38
MAT2A P31153 2/20 0.35
PTPN5 P54829 1/20 0.35
POLB P06746 1/20 0.34
GRIA2 P42262 1/20 0.34
GRIA4 P48058 1/20 0.34
KDM4A O75164 1/20 0.34
KDM5B Q9UGL1 1/20 0.34
SERPINE1 P05121 1/20 0.33
GABRP O00591 1/20 0.33
GABRD O14764 1/20 0.33
GABRA1 P14867 1/20 0.33
GABRB1 P18505 1/20 0.33
GABRG2 P18507 1/20 0.33
GABRB3 P28472 1/20 0.33
GABRA5 P31644 1/20 0.33
GABRA3 P34903 1/20 0.33
GABRA2 P47869 1/20 0.33
GABRB2 P47870 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
SCHEMBL19912536 0.96 AR (0.41) ARICMTMAT2APTPN5POLB
SCHEMBL22822135 0.94 AR (0.43) ARICMTMAT2APTPN5POLB
SCHEMBL19912378 0.94 AR (0.37) ARICMTPTPN5POLBGRIA2
SCHEMBL19912547 0.93 AR (0.34) ARICMTPOLBKDM5BRXRA
SCHEMBL19903653 0.93 AR (0.42) ARICMTMAT2APTPN5POLB
SCHEMBL19912559 0.92 RXRA (0.34) ARICMTPOLBKDM5BRXRA
SCHEMBL19912538 0.91 AR (0.44) ARICMTMAT2APTPN5POLB
SCHEMBL19912555 0.91 AR (0.34) ARICMTPOLBRXRARXRG
SCHEMBL19912541 0.91 AR (0.40) ARICMTPTPN5POLBADORA1
SCHEMBL19918017 0.91 RXRA (0.35) ARICMTPOLBKDM5BRXRA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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 (1 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-20180062086-A1 ORGANIC MOLECULES, ESPECIALLY FOR USE IN ORGANIC OPTOELECTRONIC DEVICES OR10J3, ORC3, AOC3 AR 4212/4885ICMT 127/4885MAT2A 2653/4885

“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.