SCHEMBL12374714

SCHEMBL12374714

Cc1[nH]c(=O)c(C(=O)/C=C/C2CCCCC2)c(O)c1C

nearest known ligand 0.47

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
PADI4 Q9UM07 6/20 0.47
MEN1 O00255 4/20 0.36
LMNA P02545 4/20 0.36
KMT2A Q03164 4/20 0.36
SMN1; SMN2 Q16637 4/20 0.36
MAPT P10636 3/20 0.36
HTT P42858 2/20 0.36
RAB9A P51151 4/20 0.33
CYP1A2 P05177 2/20 0.33
CYP3A4 P08684 2/20 0.33
CYP2C19 P33261 2/20 0.33
JAK2 O60674 1/20 0.33
RECQL P46063 1/20 0.33
ALDH1A1 P00352 1/20 0.33
NPC1 O15118 2/20 0.31
POLB P06746 1/20 0.31
RXFP1 Q9HBX9 1/20 0.31

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
SCHEMBL15233104 0.76 PADI4 (0.37) PADI4MEN1LMNAKMT2ASMN1; SMN2
SCHEMBL12374705 0.75 PADI4 (0.45) PADI4MEN1KMT2ARAB9AALDH1A1
SCHEMBL25373527 0.72 PADI4 (0.49) PADI4MEN1LMNAKMT2ASMN1; SMN2
SCHEMBL25373521 0.72 PADI4 (0.49) PADI4MEN1LMNAKMT2ASMN1; SMN2
SCHEMBL13403201 0.69 PADI4 (0.39) PADI4MEN1KMT2ASMN1; SMN2MAPT
SCHEMBL12374646 0.69 PADI4 (0.44) PADI4RAB9AALDH1A1NPC1
SCHEMBL13403211 0.68 PADI4 (0.37) PADI4
SCHEMBL12374649 0.67 PADI4 (0.45) PADI4MEN1LMNAKMT2ASMN1; SMN2
SCHEMBL24329076 0.66 PADI4 (0.44) PADI4LMNASMN1; SMN2MAPTALDH1A1
SCHEMBL13403218 0.65 MEN1 (0.40) PADI4MEN1KMT2ASMN1; SMN2MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7989478-B2 decreases expression of a Type I collage gene in a tissue to induce a reduction in accumulation of collagen and thereby improves tissue fibrosis SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2011-08-02 US disclosed