SCHEMBL4382398

SCHEMBL4382398

O=C(CCCCCCCCCCCCCCc1cccs1)Cc1ccc(F)cc1

nearest known ligand 0.52

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
POLB P06746 4/20 0.52
HPGD P15428 1/20 0.51
SMN1; SMN2 Q16637 4/20 0.46
LMNA P02545 3/20 0.46
ALDH1A1 P00352 2/20 0.44
TSHR P16473 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.44
NPC1 O15118 2/20 0.43
RAB9A P51151 2/20 0.42
KDM4E B2RXH2 1/20 0.42
NPSR1 Q6W5P4 1/20 0.42
USP2 O75604 1/20 0.41
PKM P14618 2/20 0.41
MAPT P10636 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
SCHEMBL7614904 0.83 POLB (0.41) POLBSMN1; SMN2ALDH1A1TSHRL3MBTL1
SCHEMBL28143250 0.81 HPGD (0.64) POLBHPGDSMN1; SMN2LMNAALDH1A1
SCHEMBL27987587 0.76 TAAR1 (0.55) POLBSMN1; SMN2LMNAALDH1A1TSHR
SCHEMBL7479624 0.76 SMN1; SMN2 (0.49) POLBHPGDSMN1; SMN2ALDH1A1TSHR
SCHEMBL6548487 0.75 DPP4 (0.49) POLBHPGDSMN1; SMN2LMNAALDH1A1
SCHEMBL4365322 0.75 NPC1 (0.68) POLBHPGDSMN1; SMN2LMNAALDH1A1
SCHEMBL4368662 0.75 NPC1 (0.68) POLBHPGDSMN1; SMN2LMNAALDH1A1
SCHEMBL4367706 0.75 NPC1 (0.68) POLBHPGDSMN1; SMN2LMNAALDH1A1
SCHEMBL713455 0.75 NPC1 (0.68) POLBHPGDSMN1; SMN2LMNAALDH1A1
SCHEMBL4369177 0.75 NPC1 (0.68) POLBHPGDSMN1; SMN2LMNAALDH1A1

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-0760811-B1 IMIDAZOLE DERIVATIVES AS HISTAMINE RECEPTOR H3 MODULATORS INST NAT SANTE RECH MED (FR) 2009-11-18 EP disclosed
EP-0760811-A1 IMIDAZOLE DERIVATIVES AS HISTAMINE RECEPTOR H 3? (ANT)AGONISTS INSTITUT NATIONAL DE LA SANTE ET DE LA RECHERCHE MEDICALE (INSERM) (FR) 1997-03-12 EP disclosed
WO-1996029315-A2 IMIDAZOLE DERIVATIVES AS HISTAMINE RECEPTOR H3 (ANT)AGONISTS INSTITUT NATIONAL DE LA SANTE ET DE LA RECHERCHE MEDICALE (FR) 1996-09-26 WO disclosed