SCHEMBL4155161

SCHEMBL4155161

Cc1cccc(N(CC[O])C(=O)c2ccccc2)c1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 4/20 0.56
NPC1 O15118 3/20 0.56
KMT2A Q03164 2/20 0.55
ALDH1A1 P00352 4/20 0.50
PAX8 Q06710 2/20 0.50
JAK2 O60674 1/20 0.50
HTT P42858 1/20 0.50
CYP3A4 P08684 1/20 0.50
CYP2C9 P11712 1/20 0.50
CYP2C19 P33261 1/20 0.50
ADRA2C P18825 1/20 0.50
HSD17B1 P14061 3/20 0.46
HSD17B2 P37059 3/20 0.46
MEN1 O00255 1/20 0.45
HPGD P15428 2/20 0.45
TDP1 Q9NUW8 1/20 0.45
TP53 P04637 1/20 0.45
GPX4 P36969 1/20 0.45
RXFP1 Q9HBX9 1/20 0.45
MAPT P10636 2/20 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
SCHEMBL11767643 0.85 MLYCD (0.57) RAB9ANPC1KMT2AALDH1A1PAX8
SCHEMBL4168860 0.84 ADRA2C (0.67) RAB9ANPC1KMT2AALDH1A1HTT
SCHEMBL19240708 0.84 RAB9A (0.55) RAB9ANPC1KMT2AALDH1A1PAX8
SCHEMBL21727428 0.83 ADRA2C (0.56) RAB9ANPC1KMT2AALDH1A1PAX8
SCHEMBL4156414 0.83 ADRA2C (0.54) RAB9ANPC1KMT2AALDH1A1HTT
SCHEMBL21727423 0.82 RAB9A (0.57) RAB9ANPC1KMT2AALDH1A1PAX8
SCHEMBL19240161 0.81 RAB9A (0.55) RAB9ANPC1KMT2AALDH1A1PAX8
SCHEMBL28490022 0.78 CYP3A4 (0.55) RAB9ANPC1KMT2AALDH1A1PAX8
SCHEMBL4164220 0.78 ALDH1A1 (0.46) RAB9ANPC1KMT2AALDH1A1PAX8
SCHEMBL4154740 0.77 TP53 (0.58) RAB9ANPC1KMT2AALDH1A1PAX8

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-20090088438-A1 NEW TYROSINE DERIVATIVES AS PPARy MODULATORS LABORATORIOS SALVAT, S.A. (ES) 2009-04-02 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-20090088438-A1 NEW TYROSINE DERIVATIVES AS PPARy MODULATORS PPARG, PPARD, TYRO3 RAB9A 2235/4885NPC1 3120/4885KMT2A 2852/4885

“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.