SCHEMBL6586326

SCHEMBL6586326

Cc1ccc2[nH]c(SCCCCCBr)nc2c1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 8/20 0.52
MAPT P10636 4/20 0.52
HTT P42858 3/20 0.52
ALDH1A1 P00352 2/20 0.49
KMT2A Q03164 2/20 0.49
MEN1 O00255 1/20 0.49
NPC1 O15118 1/20 0.48
RAB9A P51151 1/20 0.48
CYP1A2 P05177 5/20 0.46
CYP2E1 P05181 5/20 0.46
CYP3A4 P08684 5/20 0.46
CYP2C8 P10632 5/20 0.46
CYP2D6 P10635 5/20 0.46
CYP2C9 P11712 5/20 0.46
CYP2B6 P20813 5/20 0.46
CYP2C19 P33261 5/20 0.46
MAPK1 P28482 1/20 0.45
SMN1; SMN2 Q16637 1/20 0.45
GAA P10253 1/20 0.45
AR P10275 3/20 0.44

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
SCHEMBL14311148 0.93 LMNA (0.57) LMNAMAPTHTTALDH1A1KMT2A
SCHEMBL6586332 0.89 MAPT (0.65) LMNAMAPTHTTALDH1A1KMT2A
SCHEMBL6587908 0.88 CYP1A2 (0.54) LMNAMAPTHTTALDH1A1KMT2A
SCHEMBL6755644 0.86 LMNA (0.52) LMNAMAPTHTTALDH1A1KMT2A
SCHEMBL6757883 0.80 BCHE (0.71) LMNAMAPTHTTALDH1A1KMT2A
Hydrochloric Acid SCHEMBL1130674 0.79 LMNA (0.47) LMNAMAPTHTTALDH1A1KMT2A
SCHEMBL10492869 0.78 HRH4 (0.52) LMNAMAPTHTTALDH1A1KMT2A
SCHEMBL8366653 0.78 CYP1A2 (0.54) LMNAMAPTHTTALDH1A1KMT2A
SCHEMBL10492875 0.78 HRH4 (0.70) LMNAMAPTHTTALDH1A1KMT2A
SCHEMBL6604518 0.78 LMNA (0.60) LMNAMAPTHTTALDH1A1KMT2A

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
US-6815455-B1 ANTIFOAM AGENTS OF MACROPHAGES; PREVENTING ARTERIOSCLEROSIS FUJI PHOTO FILM CO., LTD. (JP) 2004-11-09 US disclosed
EP-1197487-B1 BENZIMIDAZOLE COMPOUNDS AND DRUGS CONTAINING THE SAME FUJI PHOTO FILM CO LTD (JP) 2004-01-14 EP disclosed
EP-1197487-A1 BENZIMIDAZOLE COMPOUNDS AND DRUGS CONTAINING THE SAME Fuji Photo Film Co., Ltd. (JP) 2002-04-17 EP disclosed