SCHEMBL14725798

SCHEMBL14725798

CC1(C)c2ccccc2-c2cc3c(-c4cccc5c4sc4ccccc45)cc4cc5c(cc(-c6cccc7c6sc6ccccc67)c6cc7c(cc65)C(C)(C)c5ccccc5-7)cc4c3cc21

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 1/20 0.42
PARP14 Q460N5 1/20 0.40
PRKDC P78527 7/20 0.36
MAPT P10636 2/20 0.34
PIK3CD O00329 2/20 0.33
PIK3CB P42338 2/20 0.33
BRD4 O60885 1/20 0.33
PIK3CA P42336 1/20 0.33
MTOR P42345 1/20 0.33
PIK3CG P48736 1/20 0.33
KCNH2 Q12809 1/20 0.33
BRDT Q58F21 1/20 0.33
ATM Q13315 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
GPR3 P46089 1/20 0.30
HTT P42858 1/20 0.30
PAX8 Q06710 1/20 0.30
ALDH1A1 P00352 1/20 0.30
HPGD P15428 1/20 0.30
RAB9A P51151 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
SCHEMBL15460279 0.90 ALOX5 (0.44) ALOX5PARP14PRKDCMAPTPIK3CD
SCHEMBL15460204 0.87 ALOX5 (0.41) ALOX5PARP14PRKDCMAPTPIK3CD
SCHEMBL15460318 0.87 ALOX5 (0.41) ALOX5PARP14PRKDCMAPTPIK3CD
SCHEMBL15460240 0.85 ALOX5 (0.40) ALOX5PARP14PRKDCPIK3CDPIK3CB
SCHEMBL17206428 0.83 ALOX5 (0.51) ALOX5PARP14PRKDCMAPTPIK3CD
SCHEMBL14725797 0.82 ALOX5 (0.36) ALOX5MAPTL3MBTL1GPR3ALDH1A1
SCHEMBL17886447 0.82 PARP14 (0.45) ALOX5PARP14PRKDCMAPTPIK3CD
SCHEMBL14725781 0.82 APP (0.33) PRKDCMAPT
SCHEMBL17069900 0.82 ALOX5 (0.44) ALOX5PARP14PRKDCMAPT
SCHEMBL17069912 0.82 ALOX5 (0.44) ALOX5PARP14PRKDCMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9255084-B2 Heterocyclic compound and organic light-emitting device containing the same SAMSUNG DISPLAY CO., LTD. (KR) 2016-02-09 US disclosed
US-20130048955-A1 HETEROCYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE CONTAINING THE SAME SAMSUNG MOBILE DISPLAY CO., LTD. (KR) 2013-02-28 US disclosed
US-20130048955-A1 HETEROCYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE CONTAINING THE SAME SAMSUNG MOBILE DISPLAY CO., LTD. (KR) 2013-02-28 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-20130048955-A1 HETEROCYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE CONTAINING THE SAME TRPC1, TRPC4, TRPC6 ALOX5 648/4885PARP14 1505/4885PRKDC 4431/4885

“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.