SCHEMBL7026699

SCHEMBL7026699

OB(O)CCB(O)Oc1ccccc1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA1 P00915 2/20 0.45
CA2 P00918 2/20 0.45
ALDH1A1 P00352 1/20 0.35
RECQL P46063 1/20 0.35
LTA4H P09960 3/20 0.35
TSHR P16473 1/20 0.35
KCNA3 P22001 1/20 0.34
ALOX15 P16050 1/20 0.34
CA5A P35218 2/20 0.33
CA5B Q9Y2D0 2/20 0.33
LMNA P02545 1/20 0.32
CYP2C9 P11712 1/20 0.32
CYP2C19 P33261 1/20 0.32
NR1H2 P55055 1/20 0.32
BAX Q07812 1/20 0.32
CA4 P22748 1/20 0.32
CA6 P23280 1/20 0.32
CA7 P43166 1/20 0.32
ENPP2 Q13822 1/20 0.32
CA14 Q9ULX7 1/20 0.32

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
Ethylene Glycol SCHEMBL8768999 0.94 CA1 (0.41) CA1CA2ALDH1A1RECQLLTA4H
SCHEMBL28200488 0.78 KCNA3 (0.35) CA1CA2ALDH1A1RECQLLTA4H
SCHEMBL2807977 0.76 LTA4H (0.39) CA1CA2ALDH1A1RECQLLTA4H
SCHEMBL28418010 0.71 KCNA3 (0.65) CA1CA2ALDH1A1RECQLLTA4H
Benzene SCHEMBL28134938 0.71 CA1 (0.46) CA1CA2ALDH1A1RECQLLTA4H
SCHEMBL78440 0.71 CA1 (0.46) CA1CA2ALDH1A1RECQLLTA4H
SCHEMBL28102434 0.71 CA1 (0.46) CA1CA2ALDH1A1RECQLLTA4H
SCHEMBL1878004 0.71 CA1 (0.46) CA1CA2ALDH1A1RECQLLTA4H
SCHEMBL28337059 0.71 CA1 (0.46) CA1CA2ALDH1A1RECQLLTA4H
SCHEMBL862054 0.70 CA1 (0.41) CA1CA2ALDH1A1RECQLLTA4H

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1025142-B1 PROCESS FOR PREPARING CONJUGATED POLYMERS DOW GLOBAL TECHNOLOGIES INC (US) 2003-02-26 EP disclosed
EP-1025142-A1 PROCESS FOR PREPARING CONJUGATED POLYMERS THE DOW CHEMICAL COMPANY (US) 2000-08-09 EP disclosed
WO-1999020675-A1 PROCESS FOR PREPARING CONJUGATED POLYMERS THE DOW CHEMICAL COMPANY (US) 1999-04-29 WO disclosed
US-5777070-A Process for preparing conjugated polymers THE DOW CHEMICAL COMPANY (US) 1998-07-07 US disclosed