SCHEMBL8945113

SCHEMBL8945113

[CH2]CC(C)CCCCC(C)C

nearest known ligand 0.63

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.63
BLM P54132 1/20 0.39
MEN1 O00255 1/20 0.39
CYP3A4 P08684 1/20 0.39
ALOX15 P16050 1/20 0.39
KMT2A Q03164 1/20 0.39
PTPN1 P18031 1/20 0.34

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
SCHEMBL10965422 0.97 LMNA (0.60) LMNABLMMEN1CYP3A4ALOX15
SCHEMBL6557927 0.94 LMNA (0.63) LMNABLMMEN1CYP3A4ALOX15
SCHEMBL1263924 0.94 LMNA (0.63) LMNABLMMEN1CYP3A4ALOX15
SCHEMBL93604 0.94 LMNA (0.63) LMNABLMMEN1CYP3A4ALOX15
SCHEMBL23112809 0.92 LMNA (0.68) LMNABLMMEN1CYP3A4ALOX15
SCHEMBL100706 0.92 LMNA (0.68) LMNABLMMEN1CYP3A4ALOX15
SCHEMBL100561 0.92 LMNA (0.68) LMNABLMMEN1CYP3A4ALOX15
SCHEMBL3114111 0.91 LMNA (0.47) LMNA
SCHEMBL5084230 0.87 LMNA (0.55) LMNABLMMEN1CYP3A4ALOX15
SCHEMBL28603544 0.85 LMNA (0.52) LMNABLMMEN1CYP3A4ALOX15

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5510353-A TREATING IRRITABLE BOWEL SYNDROME, GASTROESOPHAGEAL REFLUX DISEASE, CONSTIPATION, MIGRAINE HEADACHES SANDOZ LTD. (CH) 1996-04-23 US disclosed