SCHEMBL8311571

SCHEMBL8311571

CCCCCCCC(c1cccc2c3c(ccc12)C=CC(C)(C)O3)N(CC)CC

nearest known ligand 0.33

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
PPARD Q03181 1/20 0.33
HSD17B10 Q99714 1/20 0.31
NR1H4 Q96RI1 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
SCHEMBL8021994 0.74 CNR1 (0.40)
SCHEMBL15548759 0.62 GPR84 (0.55) HSD17B10
SCHEMBL27309973 0.61 SIGMAR1 (0.47)
Bromide SCHEMBL28712119 0.60 SIGMAR1 (0.46)
Hydrochloric Acid SCHEMBL28709746 0.60 SIGMAR1 (0.46)
Bromide SCHEMBL28705368 0.60 SIGMAR1 (0.46)
Bromide SCHEMBL28705364 0.60 SIGMAR1 (0.46)
Hydrochloric Acid SCHEMBL28705373 0.60 SIGMAR1 (0.46)
Hydrochloric Acid SCHEMBL28712149 0.60 SIGMAR1 (0.46)
Hydrochloric Acid SCHEMBL28696445 0.60 SIGMAR1 (0.46)

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-0629626-B1 Cyclopropyl-substituted spiro-photochromic compounds TOKUYAMA CORP (JP) 1999-10-27 EP disclosed
US-5631382-A PHOTOCHROMIC LENSES TOKUYAMA CORPORATION (JP) 1997-05-20 US disclosed
EP-0629626-A2 Cyclopropyl-substituted spiro-photochromic compounds TOKUYAMA CORPORATION (JP) 1994-12-21 EP disclosed