SCHEMBL6355098

SCHEMBL6355098

O=C(C(=O)c1cc(Cl)c(Cl)c(Cl)c1Cl)c1ccccc1

nearest known ligand 0.52

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CES2 O00748 14/20 0.52
CES1 P23141 12/20 0.52
ALDH1A1 P00352 2/20 0.43
KDM4E B2RXH2 1/20 0.43
MEN1 O00255 1/20 0.43
MAPT P10636 1/20 0.43
PKM P14618 1/20 0.43
HPGD P15428 1/20 0.43
HTT P42858 1/20 0.43
KMT2A Q03164 1/20 0.43
HSD17B10 Q99714 1/20 0.43
RAB9A P51151 1/20 0.39
ADORA1 P30542 1/20 0.39

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
SCHEMBL5079583 0.83 AKR1C3 (0.48) ALDH1A1KDM4EMEN1MAPTPKM
SCHEMBL5493096 0.77 F2 (0.42) ALDH1A1KDM4EMEN1MAPTPKM
SCHEMBL29468149 0.76 CES2 (0.78) CES2CES1ALDH1A1PKMHPGD
SCHEMBL2225523 0.76 CES2 (0.78) CES2CES1ALDH1A1PKMHPGD
SCHEMBL5076702 0.76 TSHR (0.62) CES2CES1ALDH1A1MEN1KMT2A
SCHEMBL9749593 0.74 CES1 (0.62) CES2CES1ALDH1A1KDM4EMAPT
SCHEMBL27905652 0.74 CES2 (0.64) CES2CES1ALDH1A1MAPTHSD17B10
SCHEMBL1437003 0.73 CYP3A4 (0.48) ALDH1A1KDM4EMEN1MAPTPKM
SCHEMBL4954501 0.73 CES2 (0.64) CES2CES1ALDH1A1PKMHPGD
SCHEMBL8064637 0.73 CES2 (0.50) CES2CES1ALDH1A1KDM4EMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-102906215-B Photochromic material MITSUBISHI GAS CHEMICAL CO 2014-11-05 CN disclosed
CN-102906215-A Photochromic material MITSUBISHI GAS CHEMICAL CO 2013-01-30 CN disclosed
US-20050054664-A1 Anticholinergics, processes for preparing them and pharmaceutical composition containing them BOEHRINGER INGELHEIM PHARMA GMBH & CO. KG (DE) 2005-03-10 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-20050054664-A1 Anticholinergics, processes for preparing them and pharmaceutical composition containing them CHRM1, CHRM3, CHRM2 CES2 470/4885CES1 568/4885ALDH1A1 3393/4885

“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.