SCHEMBL5631270

SCHEMBL5631270

ON=C(Nc1ccc(F)c(Cl)c1)c1nonc1CNCCN1CCOCC1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EGFR P00533 6/20 0.47
EPHX2 P34913 2/20 0.44
LMNA P02545 2/20 0.44
ALDH1A1 P00352 2/20 0.43
GAA P10253 2/20 0.43
KMT2A Q03164 1/20 0.42
MAP3K8 P41279 2/20 0.41
CNR1 P21554 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
FYN P06241 1/20 0.40
ERBB2 P04626 1/20 0.40
ERBB4 Q15303 1/20 0.40
MAPK13 O15264 1/20 0.40
PRKD3 O94806 1/20 0.40
PRKCG P05129 1/20 0.40
PRKCB P05771 1/20 0.40
SRC P12931 1/20 0.40
PRKCA P17252 1/20 0.40
PRKCH P24723 1/20 0.40
PRKCI P41743 1/20 0.40

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
SCHEMBL5631259 1.00 EGFR (0.47) EGFREPHX2LMNAALDH1A1GAA
SCHEMBL5631304 0.95 EGFR (0.46) EGFREPHX2LMNAALDH1A1GAA
SCHEMBL5631314 0.95 EGFR (0.46) EGFREPHX2LMNAALDH1A1GAA
Trifluoroacetic Acid SCHEMBL5630691 0.94 EGFR (0.46) EGFREPHX2LMNAALDH1A1GAA
Trifluoroacetic Acid SCHEMBL5630684 0.94 EGFR (0.46) EGFREPHX2LMNAALDH1A1GAA
SCHEMBL5630729 0.93 HPGD (0.44) EGFREPHX2LMNAKMT2ACNR1
SCHEMBL5630724 0.93 HPGD (0.44) EGFREPHX2LMNAKMT2ACNR1
SCHEMBL5630876 0.90 RAB9A (0.38) EGFREPHX2LMNAALDH1A1KMT2A
SCHEMBL5630885 0.90 RAB9A (0.38) EGFREPHX2LMNAALDH1A1KMT2A
SCHEMBL4983159 0.90 RAB9A (0.40) EGFREPHX2LMNAKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1971583-B1 N-HYDROXYAMIDINOHETEROCYCLES AS MODULATORS OF INDOLEAMINE 2,3-DIOXYGENASE INCYTE CORP (US) 2015-03-25 EP claimed
US-8951536-B2 N-hydroxyamidinoheterocycles as modulators of indoleamine 2,3-dioxygenase INCYTE CORPORATION (US) 2015-02-10 US claimed
US-20130177590-A1 N-HYDROXYAMIDINOHETEROCYCLES AS MODULATORS OF INDOLEAMINE 2,3-DIOXYGENASE INCYTE CORPORATION (US) 2013-07-11 US claimed
US-20070185165-A1 N-hydroxyamidinoheterocycles as modulators of indoleamine 2,3-dioxygenase INCYTE CORPORATION 2007-08-09 US claimed
US-8450351-B2 N-hydroxyamidinoheterocycles as modulators of indoleamine 2,3-dioxygenase INCYTE CORPORATION (US) 2013-05-28 US disclosed
US-20070185165-A1 N-hydroxyamidinoheterocycles as modulators of indoleamine 2,3-dioxygenase INCYTE CORPORATION 2007-08-09 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-20130177590-A1 N-HYDROXYAMIDINOHETEROCYCLES AS MODULATORS OF INDOLEAMINE 2,3-DIOXYGENASE IDO1, IDO2, HNMT EGFR 1553/4885EPHX2 266/4885LMNA 4520/4885
US-20070185165-A1 N-hydroxyamidinoheterocycles as modulators of indoleamine 2,3-dioxygenase IDO1, IDO2, HNMT EGFR 1553/4885EPHX2 266/4885LMNA 4520/4885

“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.