Benzene

Benzene

SCHEMBL6861236

CC(COOC(C)(C)C)OOC(C)COOC(C)(C)C.c1ccccc1

nearest known ligand 0.30

Full drug profile on Sugi Atlas →

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.30
TDP1 Q9NUW8 1/20 0.30
MAPK1 P28482 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
SCHEMBL28403495 0.72 MTNR1A (0.34)
SCHEMBL3685965 0.72 TSHR (0.39) TSHRTDP1MAPK1
SCHEMBL1077953 0.71 RIPK1 (0.48) TSHRTDP1
SCHEMBL6905081 0.70 TSHR (0.32) TSHRTDP1
SCHEMBL9634505 0.69 MAPK1 (0.56) TSHRTDP1MAPK1
SCHEMBL20898630 0.69 TSHR (0.35) TSHRTDP1MAPK1
SCHEMBL1262776 0.69 TSHR (0.35) TSHRTDP1MAPK1
SCHEMBL20572715 0.68 CYP1A2 (0.43) TSHRTDP1MAPK1
SCHEMBL48451 0.68 TSHR (0.35) TSHRTDP1MAPK1
SCHEMBL28217326 0.67 RIPK1 (0.44)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6790147-B2 Low modulus golf ball compositions and methods for making same ACUSHNET COMPANY 2004-09-14 US disclosed
US-20030195062-A1 Low modulus golf ball compositions and methods for making same JPMORGAN CHASE BANK, N.A., AS SUCCESSOR ADMINISTRATIVE AGENT 2003-10-16 US disclosed