SCHEMBL4149801

SCHEMBL4149801

c1ccc2cc(-c3ccc4c(c3)oc3ccccc34)ccc2c1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HCRTR1 O43613 1/20 0.52
AHR P35869 2/20 0.52
MEN1 O00255 3/20 0.50
MAPT P10636 3/20 0.50
KMT2A Q03164 3/20 0.50
KDM4E B2RXH2 2/20 0.50
ALDH1A1 P00352 2/20 0.50
HPGD P15428 2/20 0.50
CYP1A1 P04798 1/20 0.46
CYP1B1 Q16678 1/20 0.46
ESR1 P03372 1/20 0.46
ESR2 Q92731 1/20 0.46
ALOX5 P09917 1/20 0.44
MMP12 P39900 1/20 0.44
MMP13 P45452 1/20 0.44
NPC1 O15118 2/20 0.43
RAB9A P51151 2/20 0.43
HSD17B1 P14061 1/20 0.43
HSD17B2 P37059 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
SCHEMBL24686218 0.95 HCRTR1 (0.49) HCRTR1AHRMEN1MAPTKMT2A
SCHEMBL12037211 0.94 ESR1 (0.50) HCRTR1AHRMEN1MAPTKMT2A
SCHEMBL12037163 0.94 ESR1 (0.50) HCRTR1AHRMEN1MAPTKMT2A
SCHEMBL26973051 0.93 HCRTR1 (0.48) HCRTR1AHRMEN1MAPTKMT2A
SCHEMBL21117278 0.93 HCRTR1 (0.48) HCRTR1AHRMEN1MAPTKMT2A
SCHEMBL12037210 0.92 ESR1 (0.48) HCRTR1AHRMEN1MAPTKMT2A
SCHEMBL22903341 0.92 HCRTR1 (0.47) HCRTR1AHRMEN1MAPTKMT2A
SCHEMBL24686652 0.92 HCRTR1 (0.47) HCRTR1AHRMEN1MAPTKMT2A
SCHEMBL23384905 0.91 AHR (0.47) HCRTR1AHRMEN1MAPTKMT2A
SCHEMBL23633531 0.91 AHR (0.47) HCRTR1AHRMEN1MAPTKMT2A

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-20090005557-A1 Electron-Conjugated Organic Silane Compound and Production Method Thereof SHARP KABUSHIKI KAISHA (JP) 2009-01-01 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-20090005557-A1 Electron-Conjugated Organic Silane Compound and Production Method Thereof MLX, RNF31, RPS4X HCRTR1 3004/4885AHR 4473/4885MEN1 568/4885

“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.