SCHEMBL8024954

SCHEMBL8024954

O=C(O)c1ccc(CC2CCCCO2)cc1

nearest known ligand 0.57

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.48
MEN1 O00255 2/20 0.48
HCAR3 P49019 2/20 0.48
TSHR P16473 1/20 0.47
HTT P42858 1/20 0.47
ALDH1A1 P00352 1/20 0.46
MGLL Q99685 1/20 0.45
HPGD P15428 1/20 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
SCHEMBL17395812 0.84 TSHR (0.44) KMT2AMEN1HCAR3TSHRHTT
SCHEMBL14097842 0.80 ESR1 (0.43) KMT2AMGLL
SCHEMBL27595482 0.80 ALDH1A1 (0.46) KMT2AMEN1HCAR3TSHRALDH1A1
SCHEMBL2783327 0.80 ALDH1A1 (0.48) KMT2AMEN1TSHRALDH1A1
SCHEMBL28263198 0.80 SLC6A2 (0.46) ALDH1A1MGLLHPGD
SCHEMBL11249479 0.78 SLC6A2 (0.45) ALDH1A1MGLLHPGD
SCHEMBL2886641 0.78 RAB9A (0.69) KMT2AMEN1TSHRALDH1A1HPGD
SCHEMBL5070934 0.77 ALDH1A1 (0.43) KMT2AMEN1HTTALDH1A1
SCHEMBL24763632 0.77 SMN1; SMN2 (0.50) TSHRHTTALDH1A1HPGD
SCHEMBL2184433 0.77 SMN1; SMN2 (0.50) TSHRHTTALDH1A1HPGD

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
EP-0816356-B1 1-(2-(1-piperidinyl)-1-ethyl)-1,3-dihydro-2H-benzimidazole derivatives and their pharmaceutical use LILLY CO ELI (GB) 2000-11-02 EP disclosed
US-6075039-A 5HT receptor binding benzimidazolylpiperidines ELI LILLY AND COMPANY LIMITED (GB) 2000-06-13 US disclosed
EP-0816356-A1 1-(2-(1-piperidinyl)-1-ethyl)-1,3-dihydro-2H-benzimidazole derivatives and their pharmaceutical use ELI LILLY AND COMPANY LIMITED (GB) 1998-01-07 EP disclosed