Coumarin

Coumarin

SCHEMBL7526019

C1=Cc2ccccc2C1.C=Cc1ccccc1.O=c1ccc2ccccc2o1

nearest known ligand 0.49

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA12 O43570 5/20 0.49
CA9 Q16790 5/20 0.49
CA1 P00915 4/20 0.49
CA2 P00918 2/20 0.49
CA3 P07451 2/20 0.49
CA4 P22748 2/20 0.49
CA5A P35218 2/20 0.49
CA7 P43166 2/20 0.49
CA14 Q9ULX7 2/20 0.49
CA5B Q9Y2D0 2/20 0.49
LMNA P02545 1/20 0.49
CA6 P23280 1/20 0.49
MCL1 Q07820 1/20 0.49
SOST Q9BQB4 1/20 0.49
TDP1 Q9NUW8 1/20 0.49
ACHE P22303 2/20 0.39
MTNR1A P48039 1/20 0.39
PGR P06401 1/20 0.36
SRD5A1 P18405 1/20 0.34
ALDH1A1 P00352 1/20 0.34

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
Coumarin SCHEMBL7633181 0.88 CA12 (0.62) CA12CA9CA1CA2CA3
Coumarin SCHEMBL265069 0.84 CA12 (0.69) CA12CA9CA1CA2CA3
Naphthalene SCHEMBL10727204 0.83 ALDH1A1 (0.47) CA1CA2ALDH1A1TSHRCYP2D6
Indene SCHEMBL9444068 0.81 ALDH1A1 (0.52) CA1CA2TDP1ALDH1A1TSHR
Indene SCHEMBL200671 0.81 ALDH1A1 (0.52) CA1CA2TDP1ALDH1A1TSHR
Indene SCHEMBL27901419 0.81 ALDH1A1 (0.37) CA1CA2ALDH1A1TSHRCYP2D6
Indene SCHEMBL8625326 0.80 ALDH1A1 (0.50) CA1CA2ALDH1A1TSHRCYP2D6
Coumarin SCHEMBL28832503 0.77 CA12 (0.57) CA12CA9CA1CA2CA3
Indene SCHEMBL27535655 0.76 ALDH1A1 (0.45) CA1CA2ALDH1A1TSHRCYP2D6
Indene SCHEMBL3169287 0.74 ALDH1A1 (0.44) CA12CA9CA1CA2CA3

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
JP-2002155256-A HOT MELT ADHESIVE TOYO CHEM CO LTD 2002-05-28 JP disclosed
EP-0140296-B1 IMPROVED COATED POLYCARBONATE ARTICLES GENERAL ELECTRIC COMPANY (US) 1989-03-08 EP disclosed
US-4550058-A AUTOMOBILES, THERMOFORMABILITY, THERMOPLASTICITY, HEAT AND CHEMICAL RESISTANCE GENERAL ELECTRIC COMPANY (US) 1985-10-29 US disclosed
EP-0140296-A2 Improved coated polycarbonate articles GENERAL ELECTRIC COMPANY (US) 1985-05-08 EP disclosed