SCHEMBL7914854

SCHEMBL7914854

O=CCCCC1CCC(N(Cc2ccccc2)Cc2ccccc2)CC1

nearest known ligand 0.46

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
YTHDC1 Q96MU7 1/20 0.46
SLC6A2 P23975 2/20 0.40
SLC6A4 P31645 2/20 0.40
KMT2A Q03164 5/20 0.38
SIGMAR1 Q99720 1/20 0.38
ACKR3 P25106 1/20 0.37
SLC6A3 Q01959 1/20 0.37
MEN1 O00255 4/20 0.36
GRIN2B Q13224 1/20 0.36
RAB9A P51151 1/20 0.36
ALDH1A1 P00352 1/20 0.36
G6PC1 P35575 1/20 0.36
CCR5 P51681 1/20 0.34
DPP7 Q9UHL4 2/20 0.34
DPP8 Q6V1X1 1/20 0.34
DPP4 P27487 1/20 0.34
DPP9 Q86TI2 1/20 0.34

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
SCHEMBL7908299 0.87 GRIN2B (0.44) SIGMAR1GRIN2BALDH1A1
SCHEMBL7908300 0.87 GRIN2B (0.44) SIGMAR1GRIN2BALDH1A1
SCHEMBL15688968 0.83 YTHDC1 (0.49) YTHDC1SLC6A2SLC6A4KMT2AACKR3
SCHEMBL28984099 0.80 YTHDC1 (0.46) YTHDC1SLC6A2SLC6A4KMT2ASIGMAR1
SCHEMBL30389917 0.80 YTHDC1 (0.46) YTHDC1SLC6A2SLC6A4KMT2ASIGMAR1
SCHEMBL7921383 0.79 YTHDC1 (0.45) YTHDC1SLC6A2SLC6A4KMT2ASIGMAR1
SCHEMBL3376962 0.79 YTHDC1 (0.58) YTHDC1SLC6A2SLC6A4KMT2AACKR3
SCHEMBL28984093 0.78 YTHDC1 (0.47) YTHDC1SLC6A2SLC6A4KMT2AACKR3
SCHEMBL30389942 0.78 YTHDC1 (0.47) YTHDC1SLC6A2SLC6A4KMT2AACKR3
SCHEMBL1543347 0.76 YTHDC1 (0.51) YTHDC1SLC6A2SLC6A4KMT2AACKR3

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-6221402-B1 CORE COMPRISING A MIXTURE OF A DRUG, LOW-SUBSTITUTED HYDROXYPROPYL CELLULOSE, MICROCRYSTALLINE CELLULOSE AND BEING COATED WITH A WATER SOLUBLE POLYMER OVERCOATED WITH A SALIVA-INSOLUBLE POLYMER PFIZER INC. 2001-04-24 US disclosed
US-6211219-B1 DRUGS, ANALGESICS AND AGONISTS MERCK SHARP & DOHME LTD. (GB) 2001-04-03 US disclosed
EP-0923572-A1 AMINOCYCLOHEXANE DERIVATIVES AS 5-HT RECEPTOR AGONISTS MERCK SHARP & DOHME LTD. (GB) 1999-06-23 EP disclosed
WO-1998003504-A1 AMINOCYCLOHEXANE DERIVATIVES AS 5-HT RECEPTOR AGONISTS MERCK SHARP & DOHME LIMITED (GB) 1998-01-29 WO disclosed