SCHEMBL12415213

SCHEMBL12415213

ON=C(Nc1ccc(F)c(Cl)c1)c1cc(OCCCN2CCOCC2)no1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 7/20 0.51
EGFR P00533 11/20 0.51
BRAF P15056 3/20 0.48
KDR P35968 3/20 0.48
ERBB2 P04626 5/20 0.47
KIT P10721 3/20 0.47
SRC P12931 3/20 0.47
ERBB3 P21860 3/20 0.47
ERBB4 Q15303 3/20 0.47
HRH3 Q9Y5N1 2/20 0.47
CIT O14578 2/20 0.47
GAK O14976 2/20 0.47
EPHB6 O15197 2/20 0.47
RIPK2 O43353 2/20 0.47
STK17B O94768 2/20 0.47
STK10 O94804 2/20 0.47
ABL1 P00519 2/20 0.47
LCK P06239 2/20 0.47
LYN P07948 2/20 0.47
RET P07949 2/20 0.47

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
SCHEMBL2184070 0.93 HRH3 (0.46) EPHX2EGFRBRAFKDRHRH3
SCHEMBL2184076 0.93 HRH3 (0.46) EPHX2EGFRBRAFKDRHRH3
SCHEMBL2184275 0.91 RAB9A (0.52) EGFRKDRERBB2
SCHEMBL2184285 0.91 RAB9A (0.52) EGFRKDRERBB2
SCHEMBL12506965 0.88 EPHX2 (0.52) EPHX2EGFRBRAFKDRERBB2
SCHEMBL14077055 0.83 MEN1 (0.43) MAPT
SCHEMBL12506969 0.81 HRH3 (0.47) EPHX2EGFRBRAFKDRHRH3
SCHEMBL2184331 0.81 MEN1 (0.54) EPHX2EGFRHRH3MAPTKCNH2
SCHEMBL12507281 0.79 RAB9A (0.52) EGFRKDRERBB2
SCHEMBL12415216 0.78 LMNA (0.51) MAPTAURKB

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-8507541-B2 N-hydroxyamidinoheterocycles as modulators of indoleamine 2,3-dioxygenase INCYTE CORPORATION (US) 2013-08-13 US disclosed
US-20110165188-A1 N-HYDROXYAMIDINOHETEROCYCLES AS MODULATORS OF INDOLEAMINE 2,3-DIOXYGENASE Incyte Corporation a Delaware corporation 2011-07-07 US disclosed
US-20080214546-A1 N-HYDROXYAMIDINOHETEROCYCLES AS MODULATORS OF INDOLEAMINE 2,3-DIOXYGENASE INCYTE CORPORATION (US) 2008-09-04 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-20080214546-A1 N-HYDROXYAMIDINOHETEROCYCLES AS MODULATORS OF INDOLEAMINE 2,3-DIOXYGENASE IDO1, IDO2, HNMT EPHX2 213/4885EGFR 2945/4885BRAF 3709/4885
US-20110165188-A1 N-HYDROXYAMIDINOHETEROCYCLES AS MODULATORS OF INDOLEAMINE 2,3-DIOXYGENASE IDO1, IDO2, HNMT EPHX2 213/4885EGFR 2945/4885BRAF 3709/4885

“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.