SCHEMBL6935201

SCHEMBL6935201

C=CCSc1nnc(Cl)c(C)c1C

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.42
SMN1; SMN2 Q16637 2/20 0.39
TDP1 Q9NUW8 1/20 0.34
MEN1 O00255 3/20 0.33
KMT2A Q03164 3/20 0.33
HPGD P15428 3/20 0.33
MAPK1 P28482 2/20 0.33
HSD17B10 Q99714 2/20 0.33
NPC1 O15118 1/20 0.33
TP53 P04637 1/20 0.33
ALOX15 P16050 1/20 0.33
NFKB1 P19838 1/20 0.33
RAB9A P51151 1/20 0.33
NFKB2 Q00653 1/20 0.33
RELA Q04206 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
MAPT P10636 1/20 0.32
CRHBP P24387 1/20 0.32
CRHR2 Q13324 1/20 0.32
LMNA P02545 1/20 0.32

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
SCHEMBL6939766 0.75 ALDH1A1 (0.40) ALDH1A1SMN1; SMN2HPGDMAPK1HSD17B10
SCHEMBL6937570 0.73 ALDH1A1 (0.41) ALDH1A1SMN1; SMN2HPGDMAPK1HSD17B10
SCHEMBL6940069 0.70 TDP1 (0.37) ALDH1A1TDP1MAPK1RAB9AL3MBTL1
SCHEMBL6939514 0.70 ALDH1A1 (0.50) ALDH1A1SMN1; SMN2TDP1MEN1KMT2A
SCHEMBL11369132 0.68 TDP1 (0.35) ALDH1A1SMN1; SMN2TDP1MEN1KMT2A
SCHEMBL581530 0.67 PDE10A (0.33) TDP1
SCHEMBL11217150 0.64 TDP1 (0.38) ALDH1A1SMN1; SMN2TDP1MEN1KMT2A
SCHEMBL8536797 0.64 ALDH1A1 (0.36) ALDH1A1SMN1; SMN2TDP1MEN1KMT2A
SCHEMBL9279970 0.62 L3MBTL1 (0.35) ALDH1A1SMN1; SMN2TDP1MEN1KMT2A
SCHEMBL4387705 0.62 SMN1; SMN2 (0.44) ALDH1A1SMN1; SMN2TDP1MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1147477-C Novel allylthiopyridazine derivative and process for producing the same ��ʽ���纺����ҩ 2004-04-28 CN disclosed
EP-1058681-B1 NOVEL ALLYLTHIOPYRIDAZINE DERIVATIVES AND PROCESS FOR PREPARING THE SAME SEOUL PHARM CO LTD (KR) 2003-05-07 EP disclosed
CN-1285825-A Novel allylthiopyridazine derivative and process for producing the same SEOUL PHARM CO LTD (KR) 2001-02-28 CN disclosed
EP-1058681-A1 NOVEL ALLYLTHIOPYRIDAZINE DERIVATIVES AND PROCESS FOR PREPARING THE SAME Seoul Pharm. Co., Ltd. (KR) 2000-12-13 EP disclosed
US-5942511-A PROTECTION OF HUMAN TISSUE FROM RADIATION Kwon, Soon Kyoung (KR) 1999-08-24 US disclosed
WO-1999036407-A1 NOVEL ALLYLTHIOPYRIDAZINE DERIVATIVES AND PROCESS FOR PREPARING THE SAME SEOUL PHARM. CO., LTD. (KR) 1999-07-22 WO disclosed