SCHEMBL5099548

SCHEMBL5099548

COc1cccc(-c2cc(C#N)ccc2C)c1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PLAU P00749 1/20 0.46
FNTA P49354 7/20 0.46
FNTB P49356 7/20 0.46
PGGT1B P53609 5/20 0.46
AR P10275 2/20 0.46
MAPK14 Q16539 1/20 0.46
PGR P06401 1/20 0.45
GSK3B P49841 1/20 0.44
LRRK2 Q5S007 1/20 0.44
KDM4E B2RXH2 2/20 0.44
ALDH1A1 P00352 1/20 0.44
GLA P06280 1/20 0.44
GAA P10253 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.44
TP53 P04637 1/20 0.43
HPGD P15428 1/20 0.43
HTT P42858 1/20 0.43
ADORA2A P29274 1/20 0.43
ADORA2B P29275 1/20 0.43
ADORA1 P30542 1/20 0.43

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
SCHEMBL5089020 0.84 FNTA (0.49) FNTAFNTBPGGT1B
SCHEMBL5091260 0.84 PLAU (0.48) PLAUFNTAFNTBPGGT1BAR
SCHEMBL24017185 0.84 TP53 (0.48) PLAUFNTAFNTBPGGT1BAR
SCHEMBL12687096 0.82 CYP1A1 (0.55) ALDH1A1GAAADORA2AADORA1NPSR1
SCHEMBL5098820 0.81 ADORA2A (0.47) PLAUFNTAFNTBPGGT1BAR
SCHEMBL10074338 0.81 ADORA2A (0.44) ARMAPK14LRRK2KDM4EALDH1A1
SCHEMBL30870707 0.81 PLAU (0.46) PLAUFNTAFNTBPGGT1BAR
SCHEMBL7446928 0.80 PGR (0.55) PLAUARPGRGSK3BKDM4E
SCHEMBL5094201 0.80 FNTA (0.53) PLAUFNTAFNTBPGGT1BTP53
SCHEMBL277912 0.79 ACHE (0.57) KDM4EALDH1A1GLAL3MBTL1TP53

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11858952-B2 Compound and color conversion film comprising same LG CHEM, LTD. (KR) 2024-01-02 US disclosed
US-20210347790-A1 COMPOUND AND COLOR CONVERSION FILM COMPRISING SAME LG CHEM, LTD. (KR) 2021-11-11 US disclosed
US-7323570-B2 Farnesyltransferase inhibitors ABBOTT LABORATORIES (US) 2008-01-29 US disclosed
US-7211595-B2 Farnesyltransferase inhibitors ABBOTT LABORATORIES (US) 2007-05-01 US disclosed
US-20060264476-A1 Farnesyltransferase Inhibitors ABBVIE INC. 2006-11-23 US disclosed
EP-1339695-B1 FARNESYLTRANSFERASE INHIBITORS ABBOTT LAB (US) 2006-04-19 EP disclosed
US-20030087940-A1 Farnesyltransferase inhibitors ABBVIE INC. 2003-05-08 US disclosed
US-20020115640-A1 Such as 4-(((6-chloro-2-(3-chlorophenyl)-3-pyridinyl) methoxy)(1-methyl-1H-imidazol-5-yl)methyl)benzonitrile; anticancer agents ABBOTT LABORATORIES 2002-08-22 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 (5 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-20020115640-A1 Such as 4-(((6-chloro-2-(3-chlorophenyl)-3-pyridinyl) methoxy)(1-methyl-1H-imidazol-5-yl)methyl)benzonitrile; anticancer agents FNTB, FNTA, ACAT2 PLAU 3342/4885FNTA 2/4885FNTB 1/4885
US-20210347790-A1 COMPOUND AND COLOR CONVERSION FILM COMPRISING SAME BLVRB, CDYL, CRY1 PLAU 819/4885FNTA 77/4885FNTB 204/4885
US-20060264476-A1 Farnesyltransferase Inhibitors FNTB, FNTA, FDPS PLAU 2232/4885FNTA 2/4885FNTB 1/4885
US-11858952-B2 Compound and color conversion film comprising same BLVRB, CDYL, CRY1 PLAU 819/4885FNTA 77/4885FNTB 204/4885
US-20030087940-A1 Farnesyltransferase inhibitors FNTB, FNTA, FDPS PLAU 2353/4885FNTA 2/4885FNTB 1/4885

“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.