SCHEMBL8029639

SCHEMBL8029639

CCCC(CN1CCN(Cc2ccccc2)CC1)Oc1ccccc1

nearest known ligand 0.50

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
SIGMAR1 Q99720 4/20 0.50
KDM4E B2RXH2 5/20 0.48
MC4R P32245 1/20 0.47
KMT2A Q03164 4/20 0.47
MEN1 O00255 3/20 0.47
NPC1 O15118 3/20 0.47
ALDH1A1 P00352 2/20 0.47
TP53 P04637 2/20 0.47
SMN1; SMN2 Q16637 2/20 0.47
TDP1 Q9NUW8 1/20 0.47
NPSR1 Q6W5P4 1/20 0.47
POLB P06746 2/20 0.46
LMNA P02545 1/20 0.46
RAB9A P51151 2/20 0.44
DRD4 P21917 1/20 0.43
IGF1R P08069 1/20 0.43
LTA4H P09960 1/20 0.43

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
SCHEMBL8029642 0.92 SIGMAR1 (0.54) SIGMAR1KDM4EMC4RKMT2AMEN1
SCHEMBL8031421 0.92 SIGMAR1 (0.48) SIGMAR1KDM4EMC4RKMT2AMEN1
SCHEMBL8035801 0.90 NPC1 (0.46) SIGMAR1KDM4EMC4RKMT2AMEN1
SCHEMBL8029908 0.89 SIGMAR1 (0.53) SIGMAR1KDM4EKMT2AMEN1NPC1
SCHEMBL8031455 0.89 SIGMAR1 (0.53) SIGMAR1KDM4EMC4RKMT2AMEN1
SCHEMBL8033363 0.87 HRH3 (0.49) SIGMAR1KDM4EKMT2AMEN1NPC1
SCHEMBL8029935 0.84 SIGMAR1 (0.59) SIGMAR1KDM4EKMT2AMEN1ALDH1A1
SCHEMBL8020085 0.81 LMNA (0.59) SIGMAR1KDM4EMC4RKMT2AMEN1
SCHEMBL8029654 0.80 IGF1R (0.55) SIGMAR1KDM4EMC4RKMT2AMEN1
SCHEMBL5752956 0.80 KDM4E (0.54) SIGMAR1KDM4EKMT2AMEN1NPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0702010-B1 Benzopyranderivatives, process for their preparation and pharmaceutical compositions containing them ADIR (FR) 2000-03-15 EP disclosed
US-5691340-A CENTRAL NERVOUS SYSTEM DISORDERS, STROKES, CARDIOVASCULAR DISORDERS, ALZHEIMER*S DISEASE OR ANTIINFLAMMATORY AGENTS ADIR ET COMPAGNIE (FR) 1997-11-25 US disclosed
US-5668138-A AFFINITY FOR SIGMA RECEPTORS, CENTRAL NERVOUS SYSTEM DISORDERS ADIR ET COMPAGNIE (FR) 1997-09-16 US disclosed
EP-0702010-A1 Benzopyranderivatives, process for their preparation and pharmaceutical compositions containing them ADIR ET COMPAGNIE (FR) 1996-03-20 EP disclosed