SCHEMBL7375771

SCHEMBL7375771

COc1ccc(NC(=O)Nc2ccnc3ccccc23)cc1OC

nearest known ligand 0.81

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTR2C P28335 8/20 0.81
HTR2B P41595 8/20 0.81
MEN1 O00255 3/20 0.58
KMT2A Q03164 3/20 0.58
RAB9A P51151 2/20 0.58
MAPT P10636 2/20 0.58
ALDH1A1 P00352 1/20 0.58
LMNA P02545 1/20 0.58
GAK O14976 1/20 0.56
RIPK2 O43353 1/20 0.56
COQ8A Q8NI60 1/20 0.56
NLK Q9UBE8 1/20 0.56
PDGFRA P16234 4/20 0.55
KDR P35968 3/20 0.55
KDM4E B2RXH2 1/20 0.54
NPC1 O15118 1/20 0.54
SMN1; SMN2 Q16637 1/20 0.54
POLB P06746 1/20 0.53
IGF1R P08069 1/20 0.53
QPCT Q16769 1/20 0.53

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
SCHEMBL7369676 0.91 HTR2C (0.78) HTR2CHTR2BMAPTGAKRIPK2
SCHEMBL7454585 0.90 HTR2C (0.77) HTR2CHTR2BMEN1KMT2AMAPT
Hydrochloric Acid SCHEMBL7655770 0.90 HTR2C (0.77) HTR2CHTR2BGAKRIPK2COQ8A
Hydrochloric Acid SCHEMBL7652249 0.89 HTR2C (0.75) HTR2CHTR2BMEN1KMT2ARAB9A
Hydrochloric Acid SCHEMBL7664592 0.89 HTR2C (0.98) HTR2CHTR2BMEN1KMT2ARAB9A
Hydrochloric Acid SCHEMBL7660022 0.89 HTR2C (0.75) HTR2CHTR2BMAPTGAKRIPK2
Hydrochloric Acid SCHEMBL7376632 0.88 HTR2C (0.74) HTR2CHTR2BMAPTGAKRIPK2
Hydrochloric Acid SCHEMBL7373000 0.88 HTR2C (0.74) HTR2CHTR2BMEN1KMT2AMAPT
Hydrochloric Acid SCHEMBL7657753 0.86 HTR2C (0.71) HTR2CHTR2BKDRIGF1R
SCHEMBL7370903 0.84 HTR2C (0.70) HTR2CHTR2BMEN1KMT2ARAB9A

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
US-6410529-B1 DIETETICS; NON-INSULIN DEPENDENT DIABETES; SLEEP DISORDERS SMITHKLINE BEECHAM P.L.C. (GB) 2002-06-25 US claimed
US-6410529-B1 DIETETICS; NON-INSULIN DEPENDENT DIABETES; SLEEP DISORDERS SMITHKLINE BEECHAM P.L.C. (GB) 2002-06-25 US disclosed
EP-1003737-A1 PHENYL UREA AND PHENYL THIOUREA DERIVATIVES AS HFGAN72 ANTAGONISTS SMITHKLINE BEECHAM PLC (GB) 2000-05-31 EP disclosed
WO-1999009024-A1 PHENYL UREA AND PHENYL THIOUREA DERIVATIVES AS HFGAN72 ANTAGONISTS SMITHKLINE BEECHAM PLC (GB) 1999-02-25 WO disclosed