SCHEMBL3276441

SCHEMBL3276441

COC(=O)/C(Nc1ccc(F)cc1)=C(\Nc1ccc(F)cc1)C(=O)OC

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.58
MEN1 O00255 5/20 0.56
KMT2A Q03164 5/20 0.56
MAPT P10636 4/20 0.56
NPC1 O15118 3/20 0.56
RAB9A P51151 3/20 0.56
MAPK1 P28482 3/20 0.56
HTT P42858 2/20 0.56
ATM Q13315 1/20 0.54
POLB P06746 1/20 0.50
KDM4E B2RXH2 1/20 0.49
XBP1 P17861 1/20 0.49
SMN1; SMN2 Q16637 1/20 0.49
MAOA P21397 1/20 0.49
MAOB P27338 1/20 0.49
TGM2 P21980 1/20 0.48
CA12 O43570 1/20 0.47
CA1 P00915 1/20 0.47
CA2 P00918 1/20 0.47
CA4 P22748 1/20 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
SCHEMBL3276446 1.00 ALDH1A1 (0.58) ALDH1A1MEN1KMT2AMAPTNPC1
SCHEMBL13381406 0.93 NPC1 (0.54) ALDH1A1MEN1KMT2AMAPTNPC1
SCHEMBL209203 0.84 MAPT (0.69) ALDH1A1MEN1KMT2AMAPTNPC1
SCHEMBL13381413 0.82 MAPT (0.76) ALDH1A1MEN1KMT2AMAPTNPC1
SCHEMBL3196721 0.79 NAPRT (0.56) ALDH1A1MEN1KMT2AMAPTNPC1
SCHEMBL3196710 0.79 NAPRT (0.56) ALDH1A1MEN1KMT2AMAPTNPC1
SCHEMBL2095091 0.79 SMN1; SMN2 (0.67) ALDH1A1MEN1KMT2AMAPTNPC1
SCHEMBL3276449 0.77 MAPT (0.68) ALDH1A1MEN1KMT2AMAPTNPC1
SCHEMBL13381409 0.77 MAPT (0.68) ALDH1A1MEN1KMT2AMAPTNPC1
SCHEMBL15133569 0.76 MDM2 (0.57) ALDH1A1MEN1KMT2ARAB9AKDM4E

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-7691197-B2 Method of preparing yellow pigments CABOT CORPORATION (US) 2010-04-06 US disclosed
WO-2007047975-A2 METHOD OF PREPARING YELLOW PIGMENTS CABOT CORPORATION (US) 2007-04-26 WO disclosed
US-20070089641-A1 Method of preparing yellow pigments CABOT CORPORATION 2007-04-26 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-20070089641-A1 Method of preparing yellow pigments TYR, NQO2, RB1 ALDH1A1 1681/4885MEN1 2265/4885KMT2A 323/4885

“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.