SCHEMBL8137256

SCHEMBL8137256

OCC(Cl)C1CCCCC1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TP53 P04637 2/20 0.41
KDM4E B2RXH2 2/20 0.39
LMNA P02545 2/20 0.39
GMNN O75496 1/20 0.39
MAPT P10636 1/20 0.39
BLM P54132 1/20 0.39
PMP22 Q01453 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
EPHX1 P07099 4/20 0.39
SHBG P04278 1/20 0.39
ALDH1A1 P00352 2/20 0.33
ATM Q13315 1/20 0.31
CYP2D6 P10635 2/20 0.30
MEN1 O00255 1/20 0.30
CYP1A2 P05177 1/20 0.30
TSHR P16473 1/20 0.30
KMT2A Q03164 1/20 0.30
MLNR O43193 1/20 0.30
ABCB11 O95342 1/20 0.30
EGFR P00533 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
SCHEMBL8145673 0.97
SCHEMBL8511691 0.86 TP53 (0.32) TP53TSHR
SCHEMBL11868624 0.77 TP53 (0.34) TP53KDM4ELMNAGMNNMAPT
SCHEMBL11869138 0.77 TP53 (0.35) TP53KDM4ELMNAGMNNMAPT
SCHEMBL3885036 0.76 EPHX1 (0.40) TP53KDM4ELMNAGMNNMAPT
SCHEMBL1553337 0.74 SHBG (0.56) TP53KDM4ELMNAGMNNMAPT
SCHEMBL6061503 0.74 EPHX1 (0.56) TP53KDM4ELMNAGMNNMAPT
SCHEMBL27625255 0.74 EPHX1 (0.44) TP53KDM4ELMNAGMNNMAPT
Cyclohexane SCHEMBL6482192 0.74 EPHX1 (0.41) TP53KDM4ELMNAGMNNMAPT
SCHEMBL185455 0.74

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2000003066-A1 METHOD OF ELECTROCHEMICALLY PRODUCING EPOXIDES PPG INDUSTRIES OHIO, INC. (US) 2000-01-20 WO claimed
US-5997716-A Method of electrochemically producing epoxides PPG INDUSTRIES OHIO, INC. (US) 1999-12-07 US claimed
US-5997715-A Method of electrochemically producing epoxides PPG INDUSTRIES OHIO, INC. (US) 1999-12-07 US claimed
US-5980724-A Method of electrochemically producing epoxides PPG INDUSTRIES OHIO, INC. (US) 1999-11-09 US claimed
US-5972195-A Method of electrolytically producing epoxides PPG INDUSTRIES OHIO, INC. (US) 1999-10-26 US claimed
WO-2000003066-A1 METHOD OF ELECTROCHEMICALLY PRODUCING EPOXIDES PPG INDUSTRIES OHIO, INC. (US) 2000-01-20 WO disclosed
US-5997715-A Method of electrochemically producing epoxides PPG INDUSTRIES OHIO, INC. (US) 1999-12-07 US disclosed
US-5997716-A Method of electrochemically producing epoxides PPG INDUSTRIES OHIO, INC. (US) 1999-12-07 US disclosed
US-5980724-A Method of electrochemically producing epoxides PPG INDUSTRIES OHIO, INC. (US) 1999-11-09 US disclosed
US-5972195-A Method of electrolytically producing epoxides PPG INDUSTRIES OHIO, INC. (US) 1999-10-26 US disclosed