SCHEMBL4685576

SCHEMBL4685576

C=CC(=C)Cc1cccc2ccccc12

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TDP1 Q9NUW8 2/20 0.55
▸ MEN1 O00255 3/20 0.46
▸ KMT2A Q03164 3/20 0.46
▸ KDM4E B2RXH2 2/20 0.46
▸ ALDH1A1 P00352 1/20 0.46
▸ POLB P06746 1/20 0.46
▸ MAPT P10636 1/20 0.46
▸ NPSR1 Q6W5P4 1/20 0.46
▸ CYP1A2 P05177 2/20 0.46
▸ CYP2C19 P33261 2/20 0.46
▸ CYP2C9 P11712 1/20 0.46
▸ ACP3 P15309 1/20 0.44
▸ CYP2D6 P10635 1/20 0.43
▸ ATM Q13315 1/20 0.43
▸ L3MBTL1 Q9Y468 2/20 0.42
▸ HPGD P15428 2/20 0.41
▸ HTT P42858 1/20 0.41
▸ LMNA P02545 1/20 0.41
▸ PTGER4 P35408 1/20 0.41
▸ SMN1; SMN2 Q16637 1/20 0.41

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
SCHEMBL5326921 0.80 TDP1 (0.62) TDP1MEN1KMT2AKDM4EALDH1A1
SCHEMBL28358062 0.79 TDP1 (0.66) TDP1MEN1KMT2AKDM4ECYP1A2
SCHEMBL12437052 0.77 TDP1 (0.58) TDP1MEN1KMT2AKDM4ECYP1A2
SCHEMBL6027916 0.77 TDP1 (0.58) TDP1MEN1KMT2AKDM4EALDH1A1
SCHEMBL13751485 0.76 ATM (0.56) TDP1MEN1KMT2ACYP1A2CYP2C19
Acrylamide SCHEMBL28810718 0.76 TDP1 (0.53) TDP1MEN1KMT2AKDM4EALDH1A1
SCHEMBL13703562 0.75 TDP1 (0.44) TDP1MEN1KMT2AKDM4EALDH1A1
SCHEMBL17435206 0.74 TDP1 (0.70) TDP1MEN1KMT2AKDM4EALDH1A1
SCHEMBL607974 0.74 LOXL2 (0.51) MEN1KMT2AKDM4EALDH1A1MAPT
SCHEMBL9400355 0.74 KMT2A (0.59) TDP1MEN1KMT2AKDM4EALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1358231-B1 DRAG-REDUCING POLYMERS AND DRAG-REDUCING POLYMER SUSPENSIONS AND SOLUTIONS CONOCOPHILLIPS CO (US) 2008-08-13 — — EP disclosed
EP-1358231-A4 DRAG-REDUCING POLYMERS AND DRAG-REDUCING POLYMER SUSPENSIONS AND SOLUTIONS CONOCOPHILLIPS CO (US) 2004-06-23 — — EP disclosed
EP-1358231-A2 DRAG-REDUCING POLYMERS AND DRAG-REDUCING POLYMER SUSPENSIONS AND SOLUTIONS Conocophillips Company (US) 2003-11-05 — — EP disclosed
US-6576732-B1 Drag-reducing polymers and drag-reducing polymer suspensions and solutions CONOCOPHILLIPS CO. 2003-06-10 — — US disclosed
WO-2002059183-A2 DRAG-REDUCING POLYMERS AND DRAG-REDUCING POLYMER SUSPENSIONS AND SOLUTIONS CONOCOPHILLIPS COMPANY (US) 2002-08-01 — — WO disclosed
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