SCHEMBL16110100

SCHEMBL16110100

CCCCCCOC(=O)C1(c2ccc(OC)cc2)OC1(c1ccc(OC)cc1)c1ccc(OC)cc1

nearest known ligand 0.44

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.40
TSHR P16473 2/20 0.40
LMNA P02545 2/20 0.40
MEN1 O00255 1/20 0.39
APAF1 O14727 1/20 0.39
USP2 O75604 1/20 0.39
HSP90AA1 P07900 1/20 0.39
NTSR1 P30989 1/20 0.39
UBE2N P61088 1/20 0.39
KMT2A Q03164 1/20 0.39
TP53 P04637 1/20 0.39
STS P08842 5/20 0.38
MMP2 P08253 2/20 0.38
MMP9 P14780 2/20 0.38
MMP8 P22894 2/20 0.38
MMP13 P45452 2/20 0.38
PLA2G4B P0C869 1/20 0.38
MIF P14174 1/20 0.38

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
SCHEMBL14967529 0.99 ALDH1A1 (0.40) ALDH1A1TSHRLMNAMEN1APAF1
SCHEMBL14967605 0.96 ALDH1A1 (0.42) ALDH1A1TSHRLMNAMEN1KMT2A
SCHEMBL14968180 0.90 CHRM1 (0.40) ALDH1A1TSHRLMNAMEN1KMT2A
SCHEMBL14967968 0.87 ALDH1A1 (0.41) ALDH1A1TSHRLMNAMEN1APAF1
SCHEMBL14967797 0.86 TSHR (0.40) ALDH1A1TSHRLMNATP53MMP9
SCHEMBL14967918 0.86 TSHR (0.49) ALDH1A1TSHRLMNAMEN1KMT2A
SCHEMBL14967624 0.85 CHRM1 (0.42) ALDH1A1LMNAUSP2KMT2ATP53
SCHEMBL14968094 0.84 TSHR (0.48) ALDH1A1TSHRLMNAMEN1KMT2A
SCHEMBL14967727 0.84 TSHR (0.39) ALDH1A1TSHRLMNAMEN1KMT2A
SCHEMBL14967821 0.84 ALDH1A1 (0.44) ALDH1A1TSHRLMNAMEN1KMT2A

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
US-10301397-B2 Method for producing polydienes and polydiene copolymers with reduced cold flow BRIDGESTONE CORPORATION (JP) 2019-05-28 US disclosed
US-20160340447-A1 METHOD FOR PRODUCING POLYDIENES AND POLYDIENE COPOLYMERS WITH REDUCED COLD FLOW BRIDGESTONE CORPORATION (JP) 2016-11-24 US disclosed
US-9458270-B2 Method for producing polydienes and polydiene copolymers with reduced cold flow BRIDGESTONE CORPORATION (JP) 2016-10-04 US disclosed
US-20140296445-A1 Method For Producing Polydienes And Polydiene Copolymers With Reduced Cold Flow BRIDGESTONE CORPORATION (JP) 2014-10-02 US disclosed