SCHEMBL7709019

SCHEMBL7709019

CC1(C)CCc2ccccc2C=C1C(=O)NC(=N)N

nearest known ligand 0.33

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.30
LMNA P02545 1/20 0.30
HPGD P15428 1/20 0.30
TSHR P16473 1/20 0.30
RAB9A P51151 1/20 0.30
HSD17B10 Q99714 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
SCHEMBL7714899 0.95 LMNA (0.32) LMNATSHRHSD17B10
SCHEMBL7714470 0.78 MAOA (0.41) LMNA
SCHEMBL7708886 0.77 TRPA1 (0.39) ALDH1A1LMNAHPGDTSHR
SCHEMBL7709005 0.75 KDM1A (0.36) ALDH1A1RAB9A
SCHEMBL7714903 0.75
SCHEMBL7759560 0.73 NOTUM (0.33) ALDH1A1RAB9A
SCHEMBL7714804 0.73 HSD17B10 (0.35) LMNAHPGDTSHRHSD17B10
SCHEMBL7714886 0.72 MTNR1A (0.33) RAB9A
SCHEMBL7385061 0.71 LMNA (0.34) LMNATSHRRAB9AHSD17B10
SCHEMBL7708912 0.71 MEN1 (0.32)

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-6369110-B1 PROPHYLACTIC AGENT FOR DISEASES CAUSED BY THE ACCELERATION OF THE SODIUM/PROTON EXCHANGE TRANSPORT SYSTEM SUMITOMO PHARMACEUTICALS COMPANY (JP) 2002-04-09 US claimed
EP-1083166-A1 NOVEL SUBSTITUTED GUANIDINE DERIVATIVES AND PROCESS FOR PRODUCING THE SAME SUMITOMO PHARMACEUTICALS COMPANY, LIMITED (JP) 2001-03-14 EP claimed
US-6369110-B1 PROPHYLACTIC AGENT FOR DISEASES CAUSED BY THE ACCELERATION OF THE SODIUM/PROTON EXCHANGE TRANSPORT SYSTEM SUMITOMO PHARMACEUTICALS COMPANY (JP) 2002-04-09 US disclosed
EP-1083166-A1 NOVEL SUBSTITUTED GUANIDINE DERIVATIVES AND PROCESS FOR PRODUCING THE SAME SUMITOMO PHARMACEUTICALS COMPANY, LIMITED (JP) 2001-03-14 EP disclosed