SCHEMBL10697650

SCHEMBL10697650

C(OCC1CO1)C1CO1.Oc1ccc(C(c2ccccc2)c2ccc(O)cc2)cc1

nearest known ligand 0.45

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 2/20 0.45
IDO1 P14902 1/20 0.40
TDO2 P48775 1/20 0.40
ALDH1A1 P00352 2/20 0.38
GLA P06280 1/20 0.38
MGLL Q99685 2/20 0.38
GAA P10253 1/20 0.37
KMT2A Q03164 1/20 0.37

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
SCHEMBL10904599 1.00 TDP1 (0.45) TDP1IDO1TDO2ALDH1A1GLA
SCHEMBL17386348 0.94 TSHR (0.39) TDP1ALDH1A1GLAGAAKMT2A
SCHEMBL16492331 0.90 TDP1 (0.53) TDP1ALDH1A1GLAMGLLKMT2A
SCHEMBL29184953 0.88 ESR1 (0.47) TDP1IDO1TDO2ALDH1A1GLA
Phenol SCHEMBL29031478 0.85 TDP1 (0.55) TDP1ALDH1A1GLAMGLLKMT2A
Phenol SCHEMBL88310 0.85 TDP1 (0.55) TDP1ALDH1A1GLAMGLLKMT2A
Phenol SCHEMBL33409 0.85 TDP1 (0.55) TDP1ALDH1A1GLAMGLLKMT2A
Phenol SCHEMBL27686847 0.85 TDP1 (0.55) TDP1ALDH1A1GLAMGLLKMT2A
Phenol SCHEMBL28186829 0.85 TDP1 (0.55) TDP1ALDH1A1GLAMGLLKMT2A
SCHEMBL28140186 0.83 TSHR (0.39) TDP1ALDH1A1GLAGAAKMT2A

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
EP-0268713-A1 Demulsifier composition and method of use thereof PETROLITE CORPORATION (US) 1988-06-01 EP disclosed
US-4626379-A REACTION PRODUCT OF BLEND OF POLYOXYALKYLENE OXIDE COPOLYMER AND VINYL MONOMER PETROLITE CORPORATION (US) 1986-12-02 US disclosed
US-4502977-A REACTION PRODUCT OF BLEND OF OXYALKYLATED MATERIALS WITH VINYL MONOMER PETROLITE CORPORATION (US) 1985-03-05 US disclosed