SCHEMBL9509660

SCHEMBL9509660

Cc1ccc(C2CCCN(C(=O)O)C2)cc1

nearest known ligand 0.60

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
PROKR1 Q8TCW9 13/20 0.60
RAB9A P51151 3/20 0.57
NPC1 O15118 2/20 0.57
TP53 P04637 2/20 0.57
TSHR P16473 1/20 0.57
SMN1; SMN2 Q16637 1/20 0.57
MAPT P10636 2/20 0.51
ALDH1A1 P00352 2/20 0.50
HTT P42858 1/20 0.50
LMNA P02545 1/20 0.49
HPGD P15428 1/20 0.49
HIF1A Q16665 1/20 0.49

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
SCHEMBL13616132 0.87 PROKR1 (0.60) PROKR1RAB9ANPC1TP53TSHR
SCHEMBL3312540 0.85 ALDH1A1 (0.62) PROKR1RAB9ANPC1TP53TSHR
SCHEMBL3737773 0.84 ALDH1A1 (0.48) PROKR1RAB9ANPC1TP53TSHR
SCHEMBL4099888 0.84 RAB9A (0.57) PROKR1RAB9ANPC1SMN1; SMN2MAPT
SCHEMBL1995415 0.84 ALDH1A1 (0.48) PROKR1RAB9ANPC1TP53TSHR
SCHEMBL23854774 0.84 ALDH1A1 (0.50) PROKR1TSHRMAPTALDH1A1HTT
SCHEMBL2552810 0.84 ALDH1A1 (0.50) PROKR1TSHRMAPTALDH1A1HTT
SCHEMBL2636630 0.81 RAB9A (0.57) PROKR1RAB9ANPC1TP53TSHR
SCHEMBL187297 0.81 ALDH1A1 (0.49) PROKR1RAB9ANPC1SMN1; SMN2MAPT
SCHEMBL1934459 0.81 ALDH1A1 (0.46) PROKR1RAB9ANPC1TSHRSMN1; SMN2

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-0300462-B1 HETEROCYCLIC PEROXYCARBOXYLIC ACIDS AUSIMONT S.p.A. (IT) 1993-09-29 EP claimed
US-5071584-A Storage stable, heat resistant AUSIMONT S.P.A. (IT) 1991-12-10 US claimed
EP-0300462-A2 Heterocyclic peroxycarboxylic acids AUSIMONT S.p.A. (IT) 1989-01-25 EP claimed