SCHEMBL7317482

SCHEMBL7317482

COC(=O)c1cc(Cl)cc2c1O[C@H]1CCCC[C@H]21

nearest known ligand 0.39

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 6/20 0.39
HSD17B10 Q99714 3/20 0.39
ALDH1A1 P00352 3/20 0.39
HPGD P15428 2/20 0.39
NPSR1 Q6W5P4 1/20 0.39
OPRK1 P41145 3/20 0.38
SLC6A4 P31645 1/20 0.36
SLC6A3 Q01959 1/20 0.36
TSHR P16473 2/20 0.36
RECQL P46063 1/20 0.36
SERPINH1 P50454 1/20 0.35
SMN1; SMN2 Q16637 3/20 0.35
LMNA P02545 1/20 0.35
POLB P06746 1/20 0.35
ABL1 P00519 1/20 0.35
PTGDR Q13258 1/20 0.34
PTGDR2 Q9Y5Y4 1/20 0.34
MEN1 O00255 1/20 0.34
KMT2A Q03164 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
SCHEMBL7318335 1.00 KDM4E (0.39) KDM4EHSD17B10ALDH1A1HPGDNPSR1
SCHEMBL7311217 1.00 KDM4E (0.39) KDM4EHSD17B10ALDH1A1HPGDNPSR1
SCHEMBL7317477 1.00 KDM4E (0.39) KDM4EHSD17B10ALDH1A1HPGDNPSR1
SCHEMBL8323720 0.84 MEN1 (0.32) MEN1KMT2A
SCHEMBL7395961 0.84 HSD17B10 (0.37) KDM4EHSD17B10ALDH1A1HPGDTSHR
SCHEMBL7312354 0.84 HSD17B10 (0.37) KDM4EHSD17B10ALDH1A1HPGDTSHR
SCHEMBL9487213 0.84 HSD17B10 (0.37) KDM4EHSD17B10ALDH1A1HPGDTSHR
SCHEMBL7311245 0.84 HSD17B10 (0.37) KDM4EHSD17B10ALDH1A1HPGDTSHR
SCHEMBL7312361 0.84 HSD17B10 (0.37) KDM4EHSD17B10ALDH1A1HPGDTSHR
Hydrochloric Acid SCHEMBL8323728 0.83 HSD17B10 (0.36) KDM4EHSD17B10ALDH1A1HPGDTSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5288731-A Antiemetics, antiserotonine agents RHONE-POULENC RORER PHARMACEUTICALS INC. (US) 1994-02-22 US disclosed
US-5246942-A Central nervous system, anti-emetic and gastric prokinetic activity RHONE-POULENC RORER PHARMACEUTICALS INC. (US) 1993-09-21 US disclosed
EP-0494140-A4 DIBENZOFURANCARBOXAMIDES 1992-09-02 EP disclosed
EP-0494140-A1 DIBENZOFURANCARBOXAMIDES RORER INTERNATIONAL (HOLDINGS), INC. (US) 1992-07-15 EP disclosed
WO-1991004738-A1 DIBENZOFURANCARBOXAMIDES RORER INTERNATIONAL (HOLDINGS), INC. (US) 1991-04-18 WO disclosed
US-4959485-A 5-HT3 ANTAGONISTS RORER PHARMACEUTICAL CORPORATION (US) 1990-09-25 US disclosed
WO-1989010364-A1 DIBENZOFURANCARBOXAMIDES RORER INTERNATIONAL (OVERSEAS) INC. (US) 1989-11-02 WO disclosed
EP-0339950-A2 Dibenzofurancarboxamides, their use as pharmaceutical agents, a composition containing the same, and a process for the preparation thereof RHONE-POULENC RORER INTERNATIONAL (HOLDINGS) INC. (US) 1989-11-02 EP disclosed
US-4863921-A Dibenzofurancarboxamides and their pharmaceutical compositions and methods RORER PHARMACEUTICAL CORPORATION (US) 1989-09-05 US disclosed