SCHEMBL926151

SCHEMBL926151

O=C(Nc1cccc2cc(C(=O)O)[nH]c12)OCc1ccccc1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PLAU P00749 1/20 0.56
NPC1 O15118 2/20 0.53
RAB9A P51151 2/20 0.53
MAOB P27338 1/20 0.51
CASP3 P42574 1/20 0.50
MGLL Q99685 1/20 0.48
PTPN1 P18031 1/20 0.47
RAF1 P04049 1/20 0.47
BRAF P15056 1/20 0.47
ALDH1A1 P00352 2/20 0.47
HPGD P15428 2/20 0.47
HSD17B10 Q99714 2/20 0.47
MEN1 O00255 1/20 0.47
USP2 O75604 1/20 0.47
KMT2A Q03164 1/20 0.47
ENPP2 Q13822 2/20 0.46
KDM4E B2RXH2 1/20 0.45
CYP1A2 P05177 1/20 0.45
CYP2C9 P11712 1/20 0.45
SRD5A2 P31213 1/20 0.45

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
SCHEMBL3290935 0.79 NPC1 (0.57) PLAUNPC1RAB9AMAOBCASP3
SCHEMBL1653830 0.78 HPGD (0.46) ALDH1A1HPGDHSD17B10MEN1USP2
SCHEMBL9127304 0.77 CCKAR (0.60) NPC1RAB9A
SCHEMBL3626110 0.76 HPGD (0.53) ALDH1A1HPGDHSD17B10MEN1USP2
SCHEMBL8985906 0.76 SRD5A2 (0.60) NPC1RAB9AMGLLALDH1A1HPGD
SCHEMBL1653144 0.76 SRD5A2 (0.64) NPC1RAB9AALDH1A1HPGDHSD17B10
SCHEMBL2233522 0.74 NPC1 (0.69) PLAUNPC1RAB9AMAOBCASP3
SCHEMBL7268166 0.74 MAOB (0.61) PLAUNPC1RAB9AMAOBCASP3
SCHEMBL17420472 0.73 NPC1 (0.68) PLAUNPC1RAB9AMAOBCASP3
SCHEMBL3786444 0.73 NPC1 (0.68) PLAUNPC1RAB9AMAOBCASP3

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-7872021-B2 LXR receptor modulators LABORATORIES FOURNIER S.A. (FR) 2011-01-18 US disclosed
US-20070099960-A1 LXR receptor modulators LABORATOIRES FOURNIER S.A. (FR) 2007-05-03 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-20070099960-A1 LXR receptor modulators NR1H2, NR1H3, PPARD PLAU 4695/4885NPC1 43/4885RAB9A 3853/4885

“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.