SCHEMBL7683083

SCHEMBL7683083

Cc1c[nH]c2c1C(=O)CC(c1ccccc1F)C2

nearest known ligand 0.46

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MAP1LC3B Q9GZQ8 1/20 0.39
ALOX15 P16050 1/20 0.37
TSHR P16473 1/20 0.37
HSD17B10 Q99714 1/20 0.37
HCAR2 Q8TDS4 2/20 0.37
KMT2A Q03164 3/20 0.36
MEN1 O00255 2/20 0.36
ALDH1A1 P00352 2/20 0.36
LMNA P02545 2/20 0.35
SMN1; SMN2 Q16637 2/20 0.35
RXFP1 Q9HBX9 1/20 0.35
USP2 O75604 1/20 0.35
PKM P14618 1/20 0.35
HTT P42858 1/20 0.35
GAA P10253 1/20 0.35
RAB9A P51151 2/20 0.34
RECQL P46063 1/20 0.34
TP53 P04637 1/20 0.34
MAPT P10636 1/20 0.34

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
SCHEMBL7680997 0.87 HTR2C (0.41) MAP1LC3BALOX15TSHRHSD17B10HCAR2
SCHEMBL7678959 0.84 SMN1; SMN2 (0.49) MAP1LC3BALOX15TSHRHSD17B10HCAR2
SCHEMBL7685234 0.80 ALOX15 (0.56) MAP1LC3BALOX15TSHRHSD17B10KMT2A
SCHEMBL7683976 0.73 MAP1LC3B (0.41) MAP1LC3BALOX15TSHRHSD17B10KMT2A
SCHEMBL7689215 0.73 TSHR (0.55) MAP1LC3BTSHRHSD17B10HCAR2KMT2A
SCHEMBL7680811 0.72
SCHEMBL27550390 0.72 ALDH1A1 (0.33) MAP1LC3BHCAR2KMT2AMEN1ALDH1A1
SCHEMBL7689622 0.71 HSP90AA1 (0.41) MAP1LC3BALOX15TSHRHSD17B10KMT2A
SCHEMBL425265 0.69 KDM1A (0.50) MAP1LC3BHCAR2KMT2AMEN1ALDH1A1
SCHEMBL7689197 0.69 MAP1LC3B (0.36) MAP1LC3BKMT2AMEN1ALDH1A1SMN1; 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6350749-B1 SODIUM CHANNEL MODULATORS, ANTIARRHYTHMIA AND HYPOTENSIVE AGENTS; CARDIOVASCULAR DISORDERS, ANGINA PECTORIS TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 2002-02-26 US disclosed
EP-1057812-A1 AMINOGUANIDINE HYDRAZONE DERIVATIVES, PROCESS FOR PRODUCING THE SAME AND DRUGS THEREOF Takeda Chemical Industries, Ltd. (JP) 2000-12-06 EP disclosed