SCHEMBL7829702

SCHEMBL7829702

CCOC(=O)c1c(CSc2nc3ccccc3[nH]2)nc2cc(OC)c(OC)cc2c1-c1ccc(OC)c(OC)c1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SMN1; SMN2 Q16637 5/20 0.51
▸ MAPT P10636 4/20 0.51
▸ SLC10A2 Q12908 2/20 0.46
▸ ALDH1A1 P00352 4/20 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
▸ TUBB4A P04350 1/20 0.44
▸ TUBB P07437 1/20 0.44
▸ TUBA3C P0DPH7 1/20 0.44
▸ TUBA1B P68363 1/20 0.44
▸ TUBA4A P68366 1/20 0.44
▸ TUBB4B P68371 1/20 0.44
▸ TUBB3 Q13509 1/20 0.44
▸ TUBB2A Q13885 1/20 0.44
▸ TUBB8 Q3ZCM7 1/20 0.44
▸ TUBA3E Q6PEY2 1/20 0.44
▸ TUBA1A Q71U36 1/20 0.44

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
SCHEMBL7821607 0.93 SMN1; SMN2 (0.48) SMN1; SMN2MAPTALDH1A1KDM4ENSD2
SCHEMBL7834185 0.90 MAPK1 (0.49) SMN1; SMN2MAPTSLC10A2ALDH1A1KDM4E
SCHEMBL7831401 0.90 SMN1; SMN2 (0.54) SMN1; SMN2MAPTALDH1A1KDM4ELMNA
SCHEMBL7831847 0.90 SLC10A2 (0.45) SMN1; SMN2MAPTSLC10A2ALDH1A1KDM4E
SCHEMBL7833295 0.90 SLC10A2 (0.45) SMN1; SMN2MAPTSLC10A2ALDH1A1TUBB4A
SCHEMBL8734614 0.84 SLC10A2 (0.48) MAPTSLC10A2ALDH1A1KDM4ETUBB4A
SCHEMBL7829897 0.84 SLC10A2 (0.48) MAPTSLC10A2ALDH1A1TUBB4ATUBB
SCHEMBL8132332 0.83 SLC10A2 (0.46) SMN1; SMN2MAPTSLC10A2ALDH1A1KDM4E
SCHEMBL7834113 0.82 SMN1; SMN2 (0.52) SMN1; SMN2MAPTALDH1A1LMNARAB9A
SCHEMBL7820993 0.82 SLC10A2 (0.47) SMN1; SMN2MAPTSLC10A2ALDH1A1KDM4E

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 4 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
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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