SCHEMBL8544709

SCHEMBL8544709

O=C(CCNc1c(C(=O)O)[nH]c2cc(Cl)ccc12)c1cccc(F)c1

nearest known ligand 0.45

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
GPR17 Q13304 1/20 0.45
MAP2 P11137 1/20 0.41
MAPT P10636 1/20 0.40
CLK1 P49759 1/20 0.40
KMT2A Q03164 1/20 0.40

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
SCHEMBL8540189 0.89 GPR17 (0.50) GPR17MAP2MAPT
SCHEMBL8545071 0.89 KDM4E (0.45) MAPTKMT2A
SCHEMBL8543823 0.89 GPR17 (0.47) GPR17
SCHEMBL8542226 0.88 GPR17 (0.46) GPR17
SCHEMBL8545245 0.86 GRIN1 (0.47) GPR17KMT2A
SCHEMBL8542080 0.85 KMT2A (0.44) GPR17MAP2MAPTCLK1KMT2A
SCHEMBL8538337 0.79 ALDH1A1 (0.49) MAPTKMT2A
SCHEMBL8541820 0.79 KDM4E (0.46) MAPTKMT2A
SCHEMBL8541958 0.78 GPR17 (0.49) GPR17MAP2
SCHEMBL8543240 0.78 ALOX15 (0.48) MAPTKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5189054-A 3-amidoindolyl derivatives and pharmaceutical compositions thereof MERRELL DOW PHARMACEUTICALS INC. (US) 1993-02-23 US claimed
EP-0483881-B1 3-Amidoindolyl derivatives MERRELL PHARMA INC (US) 1998-01-21 EP disclosed
US-5703107-A CENTRAL NERVOUS SYSTEM DISORDERS; ANALGESICS; ANTIEPILEPTIC AGENTS MERRELL PHARMACEUTICALS INC. (US) 1997-12-30 US disclosed
US-5675018-A 3-amidoindolyl derivatives MERRELL PHARMACEUTICALS INC. (US) 1997-10-07 US disclosed
US-5491153-A 3-amidoindolyl derivative MERRELL DOW PHARMACEUTICALS INC. (US) 1996-02-13 US disclosed
US-5189054-A 3-amidoindolyl derivatives and pharmaceutical compositions thereof MERRELL DOW PHARMACEUTICALS INC. (US) 1993-02-23 US disclosed
EP-0483881-A1 3-Amidoindolyl derivatives MERRELL PHARMACEUTICALS INC. (US) 1992-05-06 EP disclosed