SCHEMBL9806367

SCHEMBL9806367

CC/C=C\CCCCC=P(c1ccccc1)(c1ccccc1)c1ccccc1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 4/20 0.41
FAAH O00519 3/20 0.41
CNR1 P21554 1/20 0.41
CNR2 P34972 1/20 0.41
ALDH1A1 P00352 4/20 0.40
F7 P08709 3/20 0.40
F3 P13726 3/20 0.40
CYP19A1 P11511 3/20 0.40
MAPT P10636 2/20 0.40
OXER1 Q8TDS5 2/20 0.40
PTGS1 P23219 2/20 0.40
PPARG P37231 2/20 0.40
KMT2A Q03164 2/20 0.40
PPARD Q03181 2/20 0.40
PPARA Q07869 2/20 0.40
KDM4E B2RXH2 1/20 0.40
MEN1 O00255 1/20 0.40
FFAR1 O14842 1/20 0.40
NR1I2 O75469 1/20 0.40
LMNA P02545 1/20 0.40

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
SCHEMBL8987951 0.82 MEN1 (0.41) EPHX2FAAHKMT2AMEN1LMNA
SCHEMBL4934443 0.81 EPHX2 (0.41) EPHX2FAAHCNR1CNR2KMT2A
SCHEMBL8756382 0.81 EPHX2 (0.41) EPHX2FAAHCNR1CNR2KMT2A
SCHEMBL11711810 0.81 EPHX2 (0.41) EPHX2FAAHCNR1CNR2KMT2A
SCHEMBL4821584 0.80 MEN1 (0.42) EPHX2ALDH1A1MAPTKMT2AMEN1
SCHEMBL8418702 0.80 EPHX2 (0.44) EPHX2FAAHCNR1CNR2ALDH1A1
SCHEMBL16284712 0.79 EPHX2 (0.36) EPHX2FAAHCNR1CNR2ALDH1A1
SCHEMBL8403328 0.77 ALDH1A1 (0.37) ALDH1A1MAPTLMNAHPGDALOX15
SCHEMBL808497 0.76 MEN1 (0.41) ALDH1A1MAPTKMT2AMEN1LMNA
SCHEMBL9801863 0.76 TSHR (0.40) ALDH1A1MAPTLMNAHPGDALOX15

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0170048-B1 ALIPHATIC THIOETHERS CIBA-GEIGY AG (CH) 1991-04-17 EP disclosed
US-4649215-A ANTIALLERGENS CIBA-GEIGY CORPORATION (US) 1987-03-10 US disclosed
EP-0170048-A2 Aliphatic thioethers CIBA-GEIGY AG (CH) 1986-02-05 EP disclosed