SCHEMBL9529572

SCHEMBL9529572

OC1CCN2CC=C(c3ccc(F)cc3)C1C2

nearest known ligand 0.38

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
CHRNA7 P36544 5/20 0.36
CHRNB2 P17787 3/20 0.36
CHRNB4 P30926 3/20 0.36
CHRNA3 P32297 3/20 0.36
CHRNA4 P43681 3/20 0.36
GBA1 P04062 1/20 0.33
MEN1 O00255 1/20 0.31
KMT2A Q03164 1/20 0.31
HRH3 Q9Y5N1 1/20 0.31
NOTUM Q6P988 1/20 0.31
SLC18A3 Q16572 2/20 0.30
SIGMAR1 Q99720 1/20 0.30
CCNT1 O60563 1/20 0.30
CCNA2 P20248 1/20 0.30
CDK2 P24941 1/20 0.30
CDK9 P50750 1/20 0.30

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
Hydrochloric Acid SCHEMBL9529197 0.99 CHRNA7 (0.36) CHRNA7CHRNB2CHRNB4CHRNA3CHRNA4
SCHEMBL9531460 0.85 CHRNA7 (0.40) CHRNA7SLC18A3
Hydrochloric Acid SCHEMBL9530432 0.84 CHRNA7 (0.39) CHRNA7SLC18A3
Hydrochloric Acid SCHEMBL9532624 0.81 MEN1 (0.36) CHRNA7MEN1KMT2AHRH3SLC18A3
Hydrochloric Acid SCHEMBL9530988 0.81 SLC18A3 (0.31) MEN1KMT2ASLC18A3
SCHEMBL9529989 0.77 CHRNA7 (0.33) CHRNA7GBA1KMT2AHRH3NOTUM
Hydrochloric Acid SCHEMBL9529691 0.76 ALDH1A1 (0.39) CHRNA7CHRNB2CHRNB4CHRNA3CHRNA4
Hydrochloric Acid SCHEMBL9532769 0.74 CHRNA7 (0.37) CHRNA7GBA1NOTUMSIGMAR1
SCHEMBL9529399 0.74 SMN1; SMN2 (0.34) MEN1KMT2A
Hydrochloric Acid SCHEMBL6669418 0.73 SMN1; SMN2 (0.36) MEN1KMT2A

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-0556342-A1 NEW 1-AZABICYCLOALKANE DERIVATIVES, PHARMACEUTICAL COMPOSITIONS CONTAINING THEM AND PROCESS FOR PREPARING SAME GYOGYSZERKUTATO INTEZET K.V. (HU) 1993-08-25 EP claimed
WO-1992007854-A1 NEW 1-AZABICYCLOALKANE DERIVATIVES, PHARMACEUTICAL COMPOSITIONS CONTAINING THEM AND PROCESS FOR PREPARING SAME GYÓGYSZERKUTATÓ INTÉZET KV. (HU) 1992-05-14 WO claimed
EP-0556342-A1 NEW 1-AZABICYCLOALKANE DERIVATIVES, PHARMACEUTICAL COMPOSITIONS CONTAINING THEM AND PROCESS FOR PREPARING SAME GYOGYSZERKUTATO INTEZET K.V. (HU) 1993-08-25 EP disclosed
WO-1992007854-A1 NEW 1-AZABICYCLOALKANE DERIVATIVES, PHARMACEUTICAL COMPOSITIONS CONTAINING THEM AND PROCESS FOR PREPARING SAME GYÓGYSZERKUTATÓ INTÉZET KV. (HU) 1992-05-14 WO disclosed