SCHEMBL7821607

SCHEMBL7821607

CCOC(=O)c1c(CSc2nc3ccccc3[nH]2)nc2cc(OC)c(OC)cc2c1-c1ccc(OC)cc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SMN1; SMN2 Q16637 6/20 0.48
▸ RAB9A P51151 5/20 0.48
▸ NPC1 O15118 4/20 0.48
▸ MEN1 O00255 3/20 0.48
▸ KMT2A Q03164 3/20 0.48
▸ NFKB1 P19838 1/20 0.48
▸ NFKB2 Q00653 1/20 0.48
▸ RELA Q04206 1/20 0.48
▸ TP53 P04637 2/20 0.46
▸ MAPT P10636 5/20 0.45
▸ PRMT5 O14744 1/20 0.44
▸ WDR77 Q9BQA1 1/20 0.44
▸ LMNA P02545 4/20 0.44
▸ ALDH1A1 P00352 3/20 0.44
▸ KDM4E B2RXH2 2/20 0.44
▸ NSD2 O96028 1/20 0.44
▸ ABL1 P00519 1/20 0.44
▸ RIN1 Q13671 1/20 0.44
▸ L3MBTL1 Q9Y468 1/20 0.44
▸ HTT P42858 1/20 0.43

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
SCHEMBL7829702 0.93 SMN1; SMN2 (0.51) SMN1; SMN2RAB9ANPC1MEN1KMT2A
SCHEMBL7834113 0.90 SMN1; SMN2 (0.52) SMN1; SMN2RAB9ANPC1MEN1KMT2A
SCHEMBL7834185 0.83 MAPK1 (0.49) SMN1; SMN2MEN1KMT2AMAPTLMNA
SCHEMBL7833295 0.83 SLC10A2 (0.45) SMN1; SMN2RAB9AKMT2AMAPTPRMT5
SCHEMBL7831847 0.83 SLC10A2 (0.45) SMN1; SMN2MEN1KMT2AMAPTLMNA
SCHEMBL7831401 0.82 SMN1; SMN2 (0.54) SMN1; SMN2RAB9ANPC1MEN1KMT2A
SCHEMBL8132011 0.79 MAPT (0.60) SMN1; SMN2RAB9ANPC1MEN1KMT2A
SCHEMBL7821104 0.78 NPC1 (0.44) SMN1; SMN2RAB9ANPC1MEN1KMT2A
SCHEMBL8734614 0.77 SLC10A2 (0.48) NPC1MEN1KMT2ATP53MAPT
SCHEMBL8886500 0.77 GAA (0.52) SMN1; SMN2MEN1KMT2ATP53MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0567107-B1 Quinoline and quinazoline derivatives for treating arthritis TAKEDA CHEMICAL INDUSTRIES LTD (JP) 2001-11-21 — — EP claimed
US-5948782-A ANTIINFLAMMATORY AGENT; RHEUMATIC DISEASES TAKEDA CHEMICAL (JP) 1999-09-07 — — US claimed
EP-0567107-A1 Quinoline and quinazoline derivatives for treating arthritis TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1993-10-27 — — EP claimed
EP-0567107-B1 Quinoline and quinazoline derivatives for treating arthritis TAKEDA CHEMICAL INDUSTRIES LTD (JP) 2001-11-21 — — EP disclosed
EP-0567107-A1 Quinoline and quinazoline derivatives for treating arthritis TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1993-10-27 — — EP disclosed
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