SCHEMBL7657640

SCHEMBL7657640

CC(=O)Nc1ccc(C)c2c1C(=O)CCO2

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.39
HPGD P15428 2/20 0.39
MAPT P10636 2/20 0.37
LMNA P02545 1/20 0.37
KDM4E B2RXH2 4/20 0.36
HSD17B10 Q99714 3/20 0.36
MAOA P21397 2/20 0.36
ALOX15 P16050 1/20 0.36
MAOB P27338 1/20 0.36
GAA P10253 1/20 0.35
KMT2A Q03164 3/20 0.35
MEN1 O00255 2/20 0.35
POLB P06746 2/20 0.34
RAB9A P51151 2/20 0.34
NPC1 O15118 1/20 0.34
CYP1A2 P05177 1/20 0.34
CYP2C19 P33261 1/20 0.34
NPSR1 Q6W5P4 1/20 0.34
CASP3 P42574 1/20 0.34
CASP1 P29466 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
SCHEMBL25692525 0.81 L3MBTL1 (0.40) ALDH1A1HPGDMAPTLMNAKDM4E
SCHEMBL31171012 0.80 MAPT (0.56) ALDH1A1HPGDMAPTLMNAKDM4E
SCHEMBL9404888 0.80 MAPT (0.56) ALDH1A1HPGDMAPTLMNAKDM4E
SCHEMBL8316043 0.78 LMNA (0.50) ALDH1A1MAPTLMNAMAOAMAOB
SCHEMBL13216300 0.77 ALDH1A1 (0.41) ALDH1A1HPGDMAPTLMNAKDM4E
SCHEMBL7653960 0.75 BAZ2B (0.42) ALDH1A1HPGDMAPTLMNAKDM4E
SCHEMBL9866665 0.74 GRM5 (0.41) MAOAKMT2AAHR
SCHEMBL7661668 0.73 KDM4E (0.38) ALDH1A1HPGDMAPTLMNAKDM4E
SCHEMBL9404823 0.72 LMNA (0.65) ALDH1A1MAPTLMNAMAOAMAOB
SCHEMBL19682929 0.72 CHRM2 (0.42) MAPTLMNAMAOAMAOB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6407115-B1 ANTICARCINOGENIC AND ANTITUMOR AGENTS; SIDE EFFECT REDUCTION, WATER SOLUBILITY DAIICHI PHARMACEUTICAL CO., LTD. (JP) 2002-06-18 US disclosed
US-5834476-A DERIVATIVE OF CAMPTOTHECIN, ANTITUMOR AGENT, ANTICARCINOGENIC AGENT DAIICHI PHARMACEUTICAL CO., LTD. (JP) 1998-11-10 US disclosed
US-5770605-A Method for treating leukemia with a hexa-cyclic compound DAIICHI PHARMACEUTICAL CO., LTD. (JP) 1998-06-23 US disclosed
US-5658920-A ANTITUMOR AGENTS DAIICHI PHARMACEUTICAL CO., LTD. (JP) 1997-08-19 US disclosed
US-5637770-A Hexa-cyclic compound DAIICHI PHARMACEUTICAL CO., LTD. (JP) 1997-06-10 US disclosed
EP-0495432-B1 Hexa-cyclic compound DAIICHI SEIYAKU CO (JP) 1996-05-29 EP disclosed
EP-0495432-A1 Hexa-cyclic compound DAIICHI PHARMACEUTICAL CO., LTD. (JP) 1992-07-22 EP disclosed
US-5061795-A ANTITUMOR AGENTS DAIICHI PHARMACEUTICAL CO., LTD. (JP) 1991-10-29 US disclosed