SCHEMBL9153145

SCHEMBL9153145

O=C1CC(CCBr)c2ccccc2N1

nearest known ligand 0.58

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.51
ALDH1A1 P00352 2/20 0.50
CREBBP Q92793 7/20 0.46
BRD4 O60885 7/20 0.46
EP300 Q09472 1/20 0.42
IDO1 P14902 1/20 0.41
TSHR P16473 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
HSD17B10 Q99714 1/20 0.39
NPC1 O15118 1/20 0.38
GSK3B P49841 1/20 0.37

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
SCHEMBL9153385 0.84 LMNA (0.54) LMNAALDH1A1CREBBPBRD4EP300
SCHEMBL9766033 0.84 LMNA (0.51) LMNAALDH1A1CREBBPBRD4EP300
SCHEMBL17969124 0.81 ALDH1A1 (0.54) LMNAALDH1A1CREBBPBRD4EP300
SCHEMBL11284893 0.80 LMNA (0.48) LMNAALDH1A1CREBBPBRD4EP300
SCHEMBL31379038 0.80 LMNA (0.60) LMNAALDH1A1CREBBPBRD4EP300
SCHEMBL29062859 0.80 LMNA (0.60) LMNAALDH1A1CREBBPBRD4EP300
SCHEMBL25789187 0.80 BRD4 (0.57) LMNAALDH1A1CREBBPBRD4EP300
SCHEMBL29960617 0.80 ALDH1A1 (0.53) LMNAALDH1A1CREBBPBRD4EP300
Hydrochloric Acid SCHEMBL29960669 0.79 ALDH1A1 (0.51) LMNAALDH1A1CREBBPBRD4EP300
SCHEMBL28558501 0.77 LMNA (0.54) LMNAALDH1A1CREBBPBRD4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5457099-A Carbostyril derivatives and antiallergic agent SAWAI PHARMACEUTICAL CO., LTD. (JP) 1995-10-10 US disclosed
EP-0577325-A1 Carbostyril derivatives and antiallergic agent SAWAI PHARMACEUTICAL CO., LTD. (JP) 1994-01-05 EP disclosed