SCHEMBL7589210

SCHEMBL7589210

O=Cc1cc(CO)c(CO)o1

nearest known ligand 0.44

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.44
TSHR P16473 1/20 0.44
CYP2A6 P11509 2/20 0.34
MCL1 Q07820 1/20 0.31
KDM4E B2RXH2 1/20 0.30
MEN1 O00255 1/20 0.30
LMNA P02545 1/20 0.30
HPGD P15428 1/20 0.30
KMT2A Q03164 1/20 0.30
AOX1 Q06278 1/20 0.30

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
SCHEMBL9483022 0.78 ALDH1A1 (0.42) ALDH1A1TSHRCYP2A6MCL1KDM4E
SCHEMBL183000 0.69 KDM4E (0.37) ALDH1A1TSHRMCL1KDM4EMEN1
SCHEMBL183359 0.67 ALOX5 (0.35) ALDH1A1KDM4EMEN1KMT2A
SCHEMBL17398808 0.66 CYP2A6 (0.42) CYP2A6
SCHEMBL14459275 0.62 ALDH1A1 (0.36) ALDH1A1TSHRCYP2A6MCL1KDM4E
SCHEMBL183630 0.62 ALDH1A1 (0.37) ALDH1A1TSHRMCL1KDM4EMEN1
SCHEMBL17398510 0.61 CYP2A6 (0.34) ALDH1A1TSHRCYP2A6
SCHEMBL28557816 0.61 ERN1 (0.38) ALDH1A1TSHRKDM4EMEN1KMT2A
Aes-103 SCHEMBL31307749 0.61
SCHEMBL4562889 0.61 SRC (0.38) ALDH1A1KDM4EMEN1LMNAHPGD

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 25 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0104309-B1 CATALYSTS FOR ALKOXYLATION REACTIONS VISTA CHEMICAL COMPANY (US) 1987-08-05 EP claimed
EP-0105080-B1 A METHOD FOR ALKOXYLATION VISTA CHEMICAL COMPANY (US) 1987-07-01 EP claimed
EP-0105080-A2 A method for alkoxylation VISTA CHEMICAL COMPANY (US) 1984-04-11 EP claimed
EP-0104309-A2 Catalysts for alkoxylation reactions VISTA CHEMICAL COMPANY (US) 1984-04-04 EP claimed
EP-0049358-A1 Strontium and barium containing alkoxylation systems for unsaturated alcohols Conoco Phillips Company (US) 1982-04-14 EP claimed
EP-0046947-A1 Strontium and barium containing alkoxylation systems Conoco Phillips Company (US) 1982-03-10 EP claimed
US-6444858-B2 VAPOR PHASE BAKER HUGHES INCORPORATED 2002-09-03 US disclosed
US-20020019572-A1 METHOD OF ETHOXYLATION USING VAPOR PHASE DISCHARGE OF ETHYLENE OXIDE BAKER HUGHES INCORPORATED 2002-02-14 US disclosed
EP-1052237-A2 Method of ethoxylation using vapor phase discharge of ethylene oxide BAKER HUGHES INCORPORATED (US) 2000-11-15 EP disclosed
EP-0095562-B1 CATALYSTS FOR ALKOXYLATION REACTIONS VISTA CHEMICAL COMPANY (US) 1988-06-01 EP disclosed
EP-0104309-B1 CATALYSTS FOR ALKOXYLATION REACTIONS VISTA CHEMICAL COMPANY (US) 1987-08-05 EP disclosed
EP-0105080-B1 A METHOD FOR ALKOXYLATION VISTA CHEMICAL COMPANY (US) 1987-07-01 EP disclosed
US-4593142-A Catalyst system containing hydrogen fluoride and a metal alkoxide VISTA CHEMICAL COMPANY (US) 1986-06-03 US disclosed
EP-0105080-A2 A method for alkoxylation VISTA CHEMICAL COMPANY (US) 1984-04-11 EP disclosed
EP-0104309-A2 Catalysts for alkoxylation reactions VISTA CHEMICAL COMPANY (US) 1984-04-04 EP disclosed
US-4376868-A Alkoxylation of cresylic acids CONOCO INC. (US) 1983-03-15 US disclosed
EP-0049358-A1 Strontium and barium containing alkoxylation systems for unsaturated alcohols Conoco Phillips Company (US) 1982-04-14 EP disclosed
EP-0046947-A1 Strontium and barium containing alkoxylation systems Conoco Phillips Company (US) 1982-03-10 EP disclosed
EP-0034648-A2 A method for the alkoxylation of alkanols in the presence of strontium-containing catalysts and promoters Conoco Phillips Company (US) 1981-09-02 EP disclosed
EP-0033760-A1 A method for the alkoxylation of alkanols Conoco Phillips Company (US) 1981-08-19 EP 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-20020019572-A1 METHOD OF ETHOXYLATION USING VAPOR PHASE DISCHARGE OF ETHYLENE OXIDE ESD, LIPG, FLOT1 ALDH1A1 687/4885TSHR 3740/4885CYP2A6 1126/4885

“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.