SCHEMBL14448337

SCHEMBL14448337

COc1ccc(N2CCN(C(=N)Nc3cccc(Cl)c3)CC2)cc1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.57
CYP3A4 P08684 1/20 0.57
CYP2C9 P11712 1/20 0.57
MAPT P10636 6/20 0.55
LMNA P02545 5/20 0.53
KMT2A Q03164 2/20 0.53
MEN1 O00255 1/20 0.53
THRB P10828 1/20 0.53
DRD4 P21917 2/20 0.52
DRD2 P14416 1/20 0.52
GAA P10253 1/20 0.50
TSHR P16473 1/20 0.50
TP53 P04637 1/20 0.50
CDK1 P06493 1/20 0.49
IGF1R P08069 1/20 0.49
FGFR1 P11362 1/20 0.49
BRAF P15056 1/20 0.49
FGFR2 P21802 1/20 0.49
FGFR4 P22455 1/20 0.49
FGFR3 P22607 1/20 0.49

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
SCHEMBL5524866 0.84 ALDH1A1 (0.55) ALDH1A1CYP3A4CYP2C9MAPTLMNA
SCHEMBL5524860 0.84 ALDH1A1 (0.55) ALDH1A1CYP3A4CYP2C9MAPTLMNA
SCHEMBL14448352 0.77 ALDH1A1 (0.68) ALDH1A1MAPTLMNAKMT2AMEN1
SCHEMBL14448354 0.76 ALDH1A1 (0.60) ALDH1A1MAPTLMNAKMT2AMEN1
SCHEMBL13234933 0.75 MAPT (0.76) ALDH1A1MAPTLMNAKMT2ATHRB
SCHEMBL10789273 0.75 MEN1 (0.49) CYP3A4CYP2C9MAPTLMNAKMT2A
SCHEMBL14448355 0.73 ALDH1A1 (0.59) ALDH1A1MAPTLMNAKMT2AMEN1
SCHEMBL5524871 0.73 MAPT (0.53) ALDH1A1CYP3A4CYP2C9MAPTLMNA
SCHEMBL10785686 0.73 MAPT (0.49) ALDH1A1MAPTLMNAKMT2AMEN1
SCHEMBL13234932 0.71 MAPT (1.00) ALDH1A1MAPTLMNAKMT2AMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20070203140-A1 N-hydroxyguanidines as modulators of indoleamine 2,3-dioxygenase INCYTE CORPORATION 2007-08-30 US disclosed
WO-2007095050-A2 N-HYDROXYGUANIDINES AS MODULATORS OF INDOLEAMINE 2,3-DIOXYGENASE INCYTE CORPORATION (US) 2007-08-23 WO 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-20070203140-A1 N-hydroxyguanidines as modulators of indoleamine 2,3-dioxygenase IDO1, IDO2, HNMT ALDH1A1 764/4885CYP3A4 745/4885CYP2C9 247/4885

“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.