SCHEMBL481896

SCHEMBL481896

OC[C@H]1CC[C@H](N(Cc2ccccc2)Cc2ccccc2)CC1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SLC6A2 P23975 2/20 0.49
SLC6A4 P31645 2/20 0.49
YTHDC1 Q96MU7 1/20 0.49
SLC6A3 Q01959 1/20 0.42
KMT2A Q03164 4/20 0.41
MEN1 O00255 3/20 0.41
GRIN2B Q13224 1/20 0.41
RAB9A P51151 1/20 0.41
ALDH1A1 P00352 1/20 0.41
KDM4E B2RXH2 1/20 0.40
HSD17B10 Q99714 1/20 0.40
ACKR3 P25106 1/20 0.39
OPRM1 P35372 2/20 0.39
OPRD1 P41143 2/20 0.39
OPRK1 P41145 2/20 0.39
CCR5 P51681 1/20 0.38
SLC18A3 Q16572 1/20 0.38
G6PC1 P35575 1/20 0.38
DPP8 Q6V1X1 1/20 0.38
DPP7 Q9UHL4 1/20 0.38

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
SCHEMBL384300 1.00 SLC6A2 (0.49) SLC6A2SLC6A4YTHDC1SLC6A3KMT2A
SCHEMBL384299 1.00 SLC6A2 (0.49) SLC6A2SLC6A4YTHDC1SLC6A3KMT2A
SCHEMBL28018410 0.90 YTHDC1 (0.43) SLC6A2SLC6A4YTHDC1SLC6A3KMT2A
SCHEMBL26038459 0.90 YTHDC1 (0.43) SLC6A2SLC6A4YTHDC1SLC6A3KMT2A
SCHEMBL28018409 0.90 YTHDC1 (0.43) SLC6A2SLC6A4YTHDC1SLC6A3KMT2A
SCHEMBL26038458 0.90 YTHDC1 (0.43) SLC6A2SLC6A4YTHDC1SLC6A3KMT2A
SCHEMBL3376962 0.87 YTHDC1 (0.58) SLC6A2SLC6A4YTHDC1SLC6A3KMT2A
SCHEMBL15689071 0.84 SLC6A2 (0.43) SLC6A2SLC6A4YTHDC1SLC6A3KMT2A
SCHEMBL20223877 0.84 SLC6A2 (0.43) SLC6A2SLC6A4YTHDC1SLC6A3KMT2A
SCHEMBL7921383 0.83 YTHDC1 (0.45) SLC6A2SLC6A4YTHDC1SLC6A3KMT2A

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 21 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10370375-B2 Heterocyclyl-substituted cyclohexylsulfonamides as JAK inhibitors ELANCO TIERGESUNDHEIT AG (US) 2019-08-06 US disclosed
US-20180346465-A1 New Compounds ELANCO TIERGESUNDHEIT AG (US) 2018-12-06 US disclosed
EP-3122731-B1 CYCLOHEXYLMETHANSULFONAMIDES ELANCO TIERGESUNDHEIT AG (CH) 2018-10-10 EP disclosed
US-10059709-B2 Compounds ELANCO TIERGESUNDHEIT AG (CH) 2018-08-28 US disclosed
EP-2457913-B1 Heteroaryl compounds, compositions thereof, and methods of treatment therewith SIGNAL PHARM LLC (US) 2017-04-19 EP disclosed
EP-2090577-B1 Heteroaryl compounds, compositions thereof, and their use as protein kinase inhibitors SIGNAL PHARM LLC (US) 2017-04-05 EP disclosed
US-20170050965-A1 New Compounds ELANCO TIERGESUNDHEIT AG (CH) 2017-02-23 US disclosed
EP-3122731-A1 NEW COMPOUNDS Novartis Tiergesundheit AG (CH) 2017-02-01 EP disclosed
WO-2015144773-A1 NEW COMPOUNDS NOVARTIS TIERGESUNDHEIT AG (CH) 2015-10-01 WO disclosed
EP-2924026-A1 Aminosulfonylmethylcyclohexanes as JAK inhibitors Novartis Tiergesundheit AG (CH) 2015-09-30 EP disclosed
EP-2457913-A2 Heteroaryl compounds, compositions thereof, and methods of treatment therewith Signal Pharmaceuticals LLC (US) 2012-05-30 EP disclosed
EP-2078016-B1 HETEROARYL COMPOUNDS, COMPOSITIONS THEREOF, AND METHODS OF TREATMENT THEREWITH SIGNAL PHARM LLC (US) 2012-02-01 EP disclosed
US-20110245245-A1 METHODS OF TREATMENT COMPRISING THE ADMINISTRATION OF HETEROARYL COMPOUNDS SIGNAL PHARMACEUTICALS, LLC 2011-10-06 US disclosed
US-7981893-B2 Heteroaryl compounds, compositions thereof, and methods of treatment therewith SIGNAL PHARMACEUTICALS, LLC (US) 2011-07-19 US disclosed
EP-2307377-A1 NICOTINAMIDE DERIVATIVES Pfizer Limited (GB) 2011-04-13 EP disclosed
WO-2009153720-A1 NICOTINAMIDE DERIVATIVES PFIZER LIMITED (GB) 2009-12-23 WO disclosed
EP-2090577-A2 Heteroaryl compounds, compositions thereof, and their use as protein kinase inhibitors Signal Pharmaceuticals LLC (US) 2009-08-19 EP disclosed
US-20090023724-A1 Heteroaryl compounds, compositions thereof, and methods of treatment therewith SIGNAL PHARMACEUTICALS, LLC 2009-01-22 US disclosed
US-7378409-B2 Substituted cycloalkylamine derivatives as modulators of chemokine receptor activity BRISTOL-MYERS SQUIBB COMPANY (US) 2008-05-27 US disclosed
US-20050054626-A1 Substituted cycloalkylamine derivatives as modulators of chemokine receptor activity BRISTOL-MYERS SQUIBB COMPANY 2005-03-10 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (7 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20180346465-A1 New Compounds HLA-DRB1, SLC10A1, NFATC1 SLC6A2 1934/4885SLC6A4 1727/4885YTHDC1 4357/4885
US-20050054626-A1 Substituted cycloalkylamine derivatives as modulators of chemokine receptor activity CCL11, CCR1, CCR2 SLC6A2 2558/4885SLC6A4 1592/4885YTHDC1 4368/4885
US-20110245245-A1 METHODS OF TREATMENT COMPRISING THE ADMINISTRATION OF HETEROARYL COMPOUNDS JAK2, GLS2, NFKBIA SLC6A2 4603/4885SLC6A4 4618/4885YTHDC1 4263/4885
US-10370375-B2 Heterocyclyl-substituted cyclohexylsulfonamides as JAK inhibitors JAK1, JAK3, JAK2 SLC6A2 3819/4885SLC6A4 3301/4885YTHDC1 3534/4885
US-20170050965-A1 New Compounds HLA-DRB1, SLC10A1, NFATC1 SLC6A2 1935/4885SLC6A4 1721/4885YTHDC1 4373/4885
US-10059709-B2 Compounds HLA-DRB1, SLC10A1, ITCH SLC6A2 1774/4885SLC6A4 1780/4885YTHDC1 4122/4885
US-20090023724-A1 Heteroaryl compounds, compositions thereof, and methods of treatment therewith JAK2, PHKG1, PHKG2 SLC6A2 4783/4885SLC6A4 4804/4885YTHDC1 3926/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.