SCHEMBL7475974

SCHEMBL7475974

CCCCCCN1CCC(c2c[nH]c3ccc(NC(=O)Nc4cccc(F)c4)cc23)CC1

nearest known ligand 0.67

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
HTR1D P28221 19/20 0.67
HTR1B P28222 16/20 0.67
CHRM2 P08172 1/20 0.67
DRD2 P14416 1/20 0.67
CCR2 P41597 1/20 0.55

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
SCHEMBL7474419 0.89 HTR1D (0.59) HTR1DHTR1BCHRM2DRD2CCR2
SCHEMBL7483816 0.89 HTR1D (0.59) HTR1DHTR1BCHRM2DRD2CCR2
SCHEMBL7487561 0.87 HTR1D (0.59) HTR1DHTR1BCHRM2DRD2CCR2
SCHEMBL7484342 0.87 HTR1D (0.58) HTR1DHTR1BCHRM2DRD2
SCHEMBL7483213 0.86 HTR1D (0.64) HTR1DHTR1BCHRM2DRD2CCR2
SCHEMBL7488305 0.86 HTR1D (0.65) HTR1DHTR1BCHRM2DRD2
SCHEMBL7477476 0.85 HTR1D (0.91) HTR1DHTR1BCHRM2DRD2
SCHEMBL27560329 0.85 HTR1D (0.67) HTR1DHTR1BCHRM2DRD2
SCHEMBL7480605 0.84 HTR1D (0.90) HTR1DHTR1BCHRM2DRD2
SCHEMBL27496223 0.84 HTR1D (0.65) HTR1DHTR1BCHRM2DRD2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0733628-B9 5-Substituted-3-(1,2,3,6-tetrahydropyridin-4-yl)- and 3-(piperidin-4-yl)-1H-indoles: 5-HT1F agonists LILLY CO ELI (US) 2002-06-12 EP disclosed
EP-0733628-B1 5-Substituted-3-(1,2,3,6-tetrahydropyridin-4-yl)- and 3-(piperidin-4-yl)-1H-indoles: 5-HT1F agonists LILLY CO ELI (US) 2000-12-27 EP disclosed
US-5962474-A ANALGESICS; HEADACHES ELI LILLY AND COMPANY (US) 1999-10-05 US disclosed
US-5708008-A TREATMENT OF MIGRAINE ELI LILLY AND COMPANY (US) 1998-01-13 US disclosed
WO-1996029075-A1 5-SUBSTITUTED-3-(1,2,3,6-TETRAHYDROPYRIDIN-4-YL)- AND 3-(PIPERIDIN-4-YL)-1H-INDOLES: NEW 5-HT1F AGONISTS ELI LILLY AND COMPANY (US) 1996-09-26 WO disclosed
EP-0733628-A1 5-Substituted-3-(1,2,3,6-tetrahydropyridin-4-yl)- and 3-(piperidin-4-yl)-1h-indoles: new 5-ht1f agonists ELI LILLY AND COMPANY (US) 1996-09-25 EP disclosed