SCHEMBL7808486

SCHEMBL7808486

Cc1ccc2[nH]c3c(c2c1)CCN[C@H]3Cc1ccc(C)c(C)c1

nearest known ligand 0.73

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
HTR2B P41595 2/20 0.72
CHRM4 P08173 5/20 0.57
HTR7 P34969 5/20 0.57
DRD2 P14416 4/20 0.57
HTR2A P28223 5/20 0.56
HTR2C P28335 2/20 0.56
GRIN2B Q13224 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
SCHEMBL7822460 1.00 HTR2B (0.72) HTR2BCHRM4HTR7DRD2HTR2A
Hydrochloric Acid SCHEMBL7816888 0.99 HTR2B (0.74) HTR2BCHRM4HTR7DRD2HTR2A
Hydrochloric Acid SCHEMBL7816431 0.99 HTR2B (0.74) HTR2BCHRM4HTR7DRD2HTR2A
SCHEMBL29462336 0.84 HTR2B (0.98) HTR2BCHRM4HTR7DRD2HTR2A
SCHEMBL11043054 0.84 HTR2B (0.98) HTR2BCHRM4HTR7DRD2HTR2A
SCHEMBL9391684 0.84 HTR2B (0.98) HTR2BCHRM4HTR7DRD2HTR2A
SCHEMBL8771830 0.84 HTR2B (0.66) HTR2BCHRM4HTR7DRD2HTR2A
Hydrochloric Acid SCHEMBL29727825 0.84 HTR2B (1.00) HTR2BCHRM4HTR7DRD2HTR2A
Hydrochloric Acid SCHEMBL7828661 0.84 HTR2B (1.00) HTR2BCHRM4HTR7DRD2HTR2A
Hydrochloric Acid SCHEMBL7808526 0.83 HTR2B (0.68) HTR2BCHRM4HTR7DRD2HTR2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5760051-A CENTRAL NERVOUS SYSTEM ELI LILLY AND COMPANY (US) 1998-06-02 US claimed
EP-0749313-A4 METHOD FOR TREATING 5HT 2B RECEPTOR RELATED CONDITIONS LILLY CO ELI (US) 2001-10-24 EP disclosed
US-6090945-A HIGH AFFINITY FOR THE 5-HT1C RECEPTOR. ELI LILLY AND COMPANY (US) 2000-07-18 US disclosed
US-5635528-A RECEPTOR BINDING MODULATORS, FOR CENTRAL NERVOUS SYSTEM DISORDERS ELI LILLY AND COMPANY (US) 1997-06-03 US disclosed
EP-0749313-A1 METHOD FOR TREATING 5HT 2B RECEPTOR RELATED CONDITIONS ELI LILLY AND COMPANY (US) 1996-12-27 EP disclosed
US-5508284-A TREATING 5-HYDROXYTRYPTAMINE MODULATION ELI LILLY AND COMPANY (US) 1996-04-16 US disclosed
US-5500431-A ANTISEROTONINE AGENTS; SEXUAL AND EATING DISORDERS ELI LILLY AND COMPANY (US) 1996-03-19 US disclosed
WO-1995024200-A1 METHOD FOR TREATING 5HT2B RECEPTOR RELATED CONDITIONS ELI LILLY AND COMPANY (US) 1995-09-14 WO disclosed
WO-1994023720-A1 TETRAHYDRO-BETA-CARBOLINES ELI LILLY AND COMPANY (US) 1994-10-27 WO disclosed
EP-0620222-A2 Tetrahydro-beta-carbolines ELI LILLY AND COMPANY (US) 1994-10-19 EP disclosed