SCHEMBL8417006

SCHEMBL8417006

O=C(O)CSc1cn(-c2ccc(F)cc2)c2ccc(Cl)cc12

nearest known ligand 0.64

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
KCNH2 Q12809 11/20 0.58
RXFP1 Q9HBX9 1/20 0.48

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
SCHEMBL8691777 0.81 KCNH2 (0.67) KCNH2
SCHEMBL6994296 0.77 KCNH2 (0.59) KCNH2
SCHEMBL8119266 0.77 KCNH2 (0.70) KCNH2
Hydrochloric Acid SCHEMBL8415377 0.77 KCNH2 (0.61) KCNH2
SCHEMBL11834266 0.73 KCNH2 (0.74) KCNH2
SCHEMBL8692641 0.72 KCNH2 (0.73) KCNH2
SCHEMBL6581418 0.72 KCNH2 (0.69) KCNH2
SCHEMBL8691781 0.72 KCNH2 (0.68) KCNH2
SCHEMBL8692637 0.71 KCNH2 (0.67) KCNH2
SCHEMBL20769670 0.70 KCNH2 (0.59) KCNH2

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-0939077-A2 3-Substituted 1-arylindole compounds as 5-HT2 antagonists H. LUNDBECK A/S (DK) 1999-09-01 EP disclosed
US-5789404-A CENTRAL NERVOUS SYSTEM DISORDERS AND ANTISEROTONIN AGENTS H. LUNDBECK A/S (DK) 1998-08-04 US disclosed
EP-0734384-A1 3-SUBSTITUTED 1-ARYLINDOLE COMPOUNDS H. LUNDBECK A/S (DK) 1996-10-02 EP disclosed
WO-1995016684-A1 3-SUBSTITUTED 1-ARYLINDOLE COMPOUNDS H. LUNDBECK A/S (DK) 1995-06-22 WO disclosed