SCHEMBL11089924

SCHEMBL11089924

O=C(O)CCC(=O)c1ccc(Cl)c(Br)c1

nearest known ligand 0.72

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
USP5 P45974 1/20 0.49
KMT2A Q03164 1/20 0.49
NR4A2 P43354 1/20 0.48
PKM P14618 1/20 0.47
TSHR P16473 1/20 0.47
CYP1A2 P05177 3/20 0.47
FFAR1 O14842 1/20 0.47
LMNA P02545 1/20 0.47
RAB9A P51151 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.47
HIF1A Q16665 1/20 0.47
ALDH1A1 P00352 3/20 0.46
CYP2C19 P33261 2/20 0.46
HPGD P15428 1/20 0.46
HSD17B10 Q99714 1/20 0.46
GAA P10253 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.44
SLC22A12 Q96S37 1/20 0.41
MMP2 P08253 1/20 0.41
MMP12 P39900 1/20 0.41

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
SCHEMBL11736603 0.86 KMT2A (0.49) USP5KMT2ANR4A2PKMTSHR
SCHEMBL727064 0.84 TSHR (0.59) USP5KMT2ANR4A2PKMTSHR
SCHEMBL17094704 0.83 HSD17B3 (0.50) KMT2ATSHRLMNARAB9ASMN1; SMN2
SCHEMBL11637468 0.81 USP5 (0.50) USP5KMT2ANR4A2PKMTSHR
SCHEMBL11658672 0.80 GSK3B (0.53) TSHRHIF1AALDH1A1
SCHEMBL5054876 0.80 GSK3B (0.57)
SCHEMBL2875993 0.79 USP5 (0.49) USP5KMT2ANR4A2PKMTSHR
SCHEMBL5378544 0.79 KMT2A (0.49) USP5KMT2ANR4A2PKMTSHR
SCHEMBL11739448 0.79 KMT2A (0.58) USP5KMT2ANR4A2PKMTSHR
SCHEMBL11536711 0.79 KMT2A (0.58) USP5KMT2ANR4A2PKMTSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4447604-A ANTICANCER AGENTS JOHN WYETH & BROTHER LIMITED (GB) 1984-05-08 US disclosed
EP-0020785-B1 HEXAHYDRONAPHTHO(1',2':4,5)IMIDAZO(2,1-B)-THIAZOLE DERIVATIVES AND PROCESS FOR PREPARING SAME TEIJIN LIMITED (JP) 1982-11-24 EP disclosed
US-4347369-A IMMUNOLOGY, ANTICARCINOGENIC, ANTIARTHRITIC, ANTHELMINTICS TEIJIN LIMITED (JP) 1982-08-31 US disclosed
US-4302585-A IMMUNOSUPRESSANTS AMERICAN HOME PRODUCTS CORPORATION (US) 1981-11-24 US disclosed
US-4293696-A IMMUNOSTIMULANTS AMERICAN HOME PRODUCTS CORPORATION (US) 1981-10-06 US disclosed
EP-0020785-A1 HEXAHYDRONAPHTHO(1',2':4,5)IMIDAZO(2,1-b)-THIAZOLE DERIVATIVES AND PROCESS FOR PREPARING SAME TEIJIN LIMITED (JP) 1981-01-07 EP disclosed
US-4052395-A AGRICULTURAL FUNGICIDAL COMPOSITIONS CONTAINING 6-(SUBSTITUTED PHENYL)-PYRIDAZINONES AND SAID PYRIDAZINONES SANKYO COMPANY LIMITED (JA) 1977-10-04 US disclosed