SCHEMBL6048619

SCHEMBL6048619

CCCCOc1ccc2ccc(O)cc2c1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.58
NPC1 O15118 1/20 0.58
ALDH1A1 P00352 1/20 0.58
GAA P10253 1/20 0.58
MAPT P10636 1/20 0.58
RAB9A P51151 1/20 0.58
KMT2A Q03164 1/20 0.58
L3MBTL1 Q9Y468 1/20 0.58
LTA4H P09960 3/20 0.58
NR5A1 Q13285 1/20 0.58
ESR1 P03372 1/20 0.48
ESR2 Q92731 1/20 0.48
CA12 O43570 1/20 0.47
CA1 P00915 1/20 0.47
CA2 P00918 1/20 0.47
CA3 P07451 1/20 0.47
CA4 P22748 1/20 0.47
CA6 P23280 1/20 0.47
CA7 P43166 1/20 0.47
CA9 Q16790 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
SCHEMBL9704804 0.96 LTA4H (0.61) MEN1NPC1ALDH1A1GAAMAPT
SCHEMBL6048620 0.95 NR5A1 (0.67) MEN1NPC1ALDH1A1GAAMAPT
SCHEMBL6048615 0.95 NR5A1 (0.67) MEN1NPC1ALDH1A1GAAMAPT
SCHEMBL9697418 0.91 NR5A1 (0.71) MEN1NPC1ALDH1A1GAAMAPT
SCHEMBL9001511 0.91 NR5A1 (0.71) MEN1NPC1ALDH1A1GAAMAPT
SCHEMBL9799612 0.91 NR5A1 (0.71) MEN1NPC1ALDH1A1GAAMAPT
SCHEMBL8956159 0.89 LTA4H (0.61) MEN1NPC1ALDH1A1GAAMAPT
SCHEMBL15772990 0.89 CA12 (0.56) NPC1RAB9ALTA4HNR5A1CA12
SCHEMBL11430217 0.87 NR5A1 (0.60) MEN1NPC1ALDH1A1GAAMAPT
SCHEMBL741708 0.85 ESR1 (0.57) MEN1NPC1ALDH1A1GAAMAPT

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-7151070-B2 Chiral catalyst, process for preparing the same and its use in the oxidate coupling of naphthols CHENGDU INSTITUTE OF ORGANIC CHEMISTRY CHINESE ACADEMY OF SCIENCES (CN) 2006-12-19 US disclosed
US-20050256345-A1 Chiral catalyst, process for preparing the same and its use in the oxidate coupling of naphthols CHENGDU INSTITUTE OF ORGANIC CHEMISTRY CHINESE ACADEMY OF SCIENCES (CN) 2005-11-17 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-20050256345-A1 Chiral catalyst, process for preparing the same and its use in the oxidate coupling of naphthols BCAT2, BCAT1, NDUFV2 MEN1 4195/4885NPC1 4643/4885ALDH1A1 1320/4885

“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.