SCHEMBL25947183

SCHEMBL25947183

COc1ccc(COc2cc(C)c(N)c(F)c2)cc1

nearest known ligand 0.50

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MAOB P27338 5/20 0.50
APP P05067 7/20 0.49
IDO1 P14902 2/20 0.45
AGXT P21549 2/20 0.45
NPC1 O15118 3/20 0.44
RAB9A P51151 3/20 0.44
MEN1 O00255 1/20 0.44
CASP3 P42574 1/20 0.44
KMT2A Q03164 1/20 0.44
SENP8 Q96LD8 1/20 0.44
SENP7 Q9BQF6 1/20 0.44
SENP6 Q9GZR1 1/20 0.44
ALDH1A1 P00352 1/20 0.43
MAPT P10636 1/20 0.43
HTT P42858 1/20 0.43
POLB P06746 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43

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
SCHEMBL25947185 0.89 MAOB (0.57) MAOBAPPIDO1AGXTNPC1
SCHEMBL25339337 0.80 ALDH1A1 (0.45) MAOBAPPNPC1RAB9AALDH1A1
SCHEMBL1578651 0.80 MAOB (0.59) MAOBAPPIDO1AGXT
SCHEMBL18713980 0.79 TAAR1 (0.48) RAB9AALDH1A1
SCHEMBL17185931 0.78 APP (0.54) MAOBAPPIDO1AGXTNPC1
SCHEMBL15173730 0.78 MAOB (0.56) MAOBAPPIDO1AGXTNPC1
SCHEMBL25338631 0.78 NPC1 (0.46) MAOBAPPIDO1AGXTNPC1
SCHEMBL18418720 0.77 APP (0.53) MAOBAPPIDO1AGXTNPC1
SCHEMBL4334787 0.77 MAOB (0.52) MAOB
SCHEMBL14895605 0.76 MAOB (0.60) MAOBAPPIDO1AGXTNPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230227483-A1 PYRIMIDINE COMPOUNDS FOR USE AS MAP4K1 INHIBITORS GLENMARK SPECIALITY S.A. (CH) 2023-07-20 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-20230227483-A1 PYRIMIDINE COMPOUNDS FOR USE AS MAP4K1 INHIBITORS MAP4K1, MAP3K4, MAP4K2 MAOB 1738/4885APP 2163/4885IDO1 4138/4885

“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.