SCHEMBL10879326

SCHEMBL10879326

CCN(CC)CCCOc1ccc(C(O)(CC)c2cccc(Cl)c2)cc1

nearest known ligand 0.51

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ SIGMAR1 Q99720 2/20 0.51
▸ EBP Q15125 1/20 0.51
▸ KDM4E B2RXH2 2/20 0.49
▸ HRH3 Q9Y5N1 3/20 0.41
▸ FDPS P14324 1/20 0.41
▸ MAOB P27338 1/20 0.41
▸ MEN1 O00255 1/20 0.41
▸ LMNA P02545 1/20 0.41
▸ KMT2A Q03164 1/20 0.41
▸ NPSR1 Q6W5P4 1/20 0.41
▸ ESR1 P03372 1/20 0.41
▸ HTT P42858 1/20 0.40
▸ BCHE P06276 1/20 0.40
▸ ACHE P22303 1/20 0.40

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
SCHEMBL10878610 0.94 EBP (0.57) SIGMAR1EBPKDM4EHRH3MEN1
SCHEMBL10794566 0.92 FDPS (0.45) SIGMAR1EBPKDM4EFDPSKMT2A
SCHEMBL10878998 0.88 EBP (0.63) SIGMAR1EBPKDM4EHRH3FDPS
SCHEMBL10893332 0.87 EBP (0.41) SIGMAR1EBPKDM4EMAOBMEN1
SCHEMBL10883714 0.86 GALR3 (0.48) SIGMAR1EBPKDM4EHRH3FDPS
SCHEMBL10741572 0.86 KDM4E (0.53) SIGMAR1EBPKDM4EHRH3MEN1
SCHEMBL10795277 0.83 LTA4H (0.44) SIGMAR1EBPKDM4EMAOBESR1
SCHEMBL10878286 0.81 EBP (0.72) SIGMAR1EBPKDM4EHRH3FDPS
SCHEMBL10880850 0.80 HRH3 (0.48) SIGMAR1EBPKDM4EHRH3FDPS
SCHEMBL10877202 0.80 EBP (0.49) SIGMAR1EBPKDM4EHRH3MEN1

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-4605672-A ANTIDEPRESSANTS; TREATMENT OF ETHANOLIC INTOXICATION; LOW TOXICITY AND FEW SIDE EFFECTS RICHTER GEDEON VEGYESZETI GYAR RT. (HU) 1986-08-12 — — US claimed
EP-0115080-B1 (OMEGA-(DIETHYLAMINO)-ALKOXY)-ALPHA-(ETHYL)-BENZHYDROL DERIVATIVES, THEIR ACID ADDITION SALTS AND QUATERNARY SALTS, PROCESS FOR THEIR PREPARATION AND MEDICINES CONTAINING THESE COMPOUNDS RICHTER GEDEON VEGYESZETI GYAR R.T. (HU) 1986-04-16 — — EP claimed
US-4605672-A ANTIDEPRESSANTS; TREATMENT OF ETHANOLIC INTOXICATION; LOW TOXICITY AND FEW SIDE EFFECTS RICHTER GEDEON VEGYESZETI GYAR RT. (HU) 1986-08-12 — — US disclosed
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