SCHEMBL1908725

SCHEMBL1908725

CN1CC[C@@H](NC(=O)C2CC2)C1

nearest known ligand 0.49

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
KDM5A P29375 12/20 0.49
POLB P06746 1/20 0.46
TSHR P16473 1/20 0.45
L3MBTL1 Q9Y468 1/20 0.45
KDM5C P41229 1/20 0.42
KDM4C Q9H3R0 1/20 0.42
KDM5B Q9UGL1 1/20 0.42
CYP2D6 P10635 1/20 0.42
HRH3 Q9Y5N1 1/20 0.42
GAA P10253 1/20 0.41
ALDH1A1 P00352 1/20 0.41
PKM P14618 1/20 0.41
SSTR1 P30872 1/20 0.41
SSTR4 P31391 1/20 0.41
CYP3A4 P08684 1/20 0.41
RAB9A P51151 1/20 0.41

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
SCHEMBL13242299 1.00 KDM5A (0.49) KDM5APOLBTSHRL3MBTL1KDM5C
SCHEMBL21037723 1.00 KDM5A (0.49) KDM5APOLBTSHRL3MBTL1KDM5C
SCHEMBL14472719 0.94 KDM5A (0.45) KDM5APOLBTSHRL3MBTL1CYP2D6
SCHEMBL16078177 0.93 TSHR (0.50) KDM5ATSHRL3MBTL1CYP2D6HRH3
SCHEMBL10265288 0.88 POLB (0.53) KDM5APOLBTSHRL3MBTL1CYP2D6
SCHEMBL16078163 0.88 KDM5A (0.47) KDM5ATSHRL3MBTL1GAAALDH1A1
SCHEMBL29983253 0.88 POLB (0.56) KDM5APOLBTSHRL3MBTL1KDM5C
SCHEMBL29983583 0.88 POLB (0.56) KDM5APOLBTSHRL3MBTL1KDM5C
SCHEMBL21277910 0.88 KDM5A (0.47) KDM5ATSHRL3MBTL1GAAALDH1A1
SCHEMBL29983305 0.88 POLB (0.56) KDM5APOLBTSHRL3MBTL1KDM5C

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10464947-B2 Tricyclic heterocycles as BET protein inhibitors INCYTE HOLDINGS CORPORATION (US) 2019-11-05 US disclosed
US-20170210754-A1 TRICYCLIC HETEROCYCLES AS BET PROTEIN INHIBITORS INCYTE HOLDINGS CORPORATION (US) 2017-07-27 US disclosed
US-9624241-B2 Tricyclic heterocycles as BET protein inhibitors INCYTE CORPORATION (US) 2017-04-18 US disclosed
US-9227985-B2 Tricyclic heterocycles as bet protein inhibitors INCYTE CORPORATION (US) 2016-01-05 US disclosed
US-20140275030-A1 TRICYCLIC HETEROCYCLES AS BET PROTEIN INHIBITORS INCYTE CORPORATION (US) 2014-09-18 US disclosed
US-8318750-B2 Organic compounds NOVARTIS AG (NL) 2012-11-27 US disclosed
US-8318750-B2 Organic compounds NOVARTIS AG (NL) 2012-11-27 US disclosed
US-8258141-B2 Organic compounds NOVARTIS AG (CH) 2012-09-04 US disclosed
US-8258141-B2 Organic compounds NOVARTIS AG (CH) 2012-09-04 US disclosed
US-8114877-B2 Antiinflammatory agnets; chronic obstructive pulmonary diseases NOVARTIS AG (CH) 2012-02-14 US disclosed
US-20120004212-A1 ORGANIC COMPOUNDS NOVARTIS AG 2012-01-05 US disclosed
EP-2322525-A1 Purine derivatives for use as adenosin A2A receptor agonists Novartis AG (CH) 2011-05-18 EP disclosed
US-20100286126-A1 Organic Compounds NOVARTIS AG (CH) 2010-11-11 US disclosed
US-20100286126-A1 Organic Compounds NOVARTIS AG (CH) 2010-11-11 US disclosed
US-20090093633-A1 Organic Compounds NOVARTIS AG 2009-04-09 US disclosed
US-20090093633-A1 Organic Compounds NOVARTIS AG 2009-04-09 US disclosed
EP-1841768-B1 PURINE DERIVATIVES ACTING AS A2A RECEPTOR AGONISTS NOVARTIS AG (CH) 2008-11-12 EP disclosed
US-20080207648-A1 Organic Compounds NOVARTIS AG (CH) 2008-08-28 US disclosed
US-20080207648-A1 Organic Compounds NOVARTIS AG (CH) 2008-08-28 US disclosed
WO-2007121920-A2 PURINE DERIVATIVES FOR USE AS ADENOSIN A2A RECEPTOR AGONISTS NOVARTIS AG (CH) 2007-11-01 WO 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-20140275030-A1 TRICYCLIC HETEROCYCLES AS BET PROTEIN INHIBITORS BRD1, BRD3, BRD2 KDM5A 2823/4885POLB 1058/4885TSHR 1769/4885
US-20090093633-A1 Organic Compounds ADORA2A, ADORA3, ADORA1 KDM5A 4712/4885POLB 2765/4885TSHR 230/4885
US-20100286126-A1 Organic Compounds CYP3A43, SLCO1B3, CYP2C19 KDM5A 4453/4885POLB 1432/4885TSHR 1199/4885
US-20120004212-A1 ORGANIC COMPOUNDS CYP3A43, SLCO1B3, CYP2C19 KDM5A 4453/4885POLB 1432/4885TSHR 1199/4885
US-20170210754-A1 TRICYCLIC HETEROCYCLES AS BET PROTEIN INHIBITORS BRD1, BRD3, BRD2 KDM5A 2823/4885POLB 1058/4885TSHR 1769/4885
US-20080207648-A1 Organic Compounds ADORA2A, ADORA1, ADORA3 KDM5A 3477/4885POLB 2576/4885TSHR 562/4885
US-10464947-B2 Tricyclic heterocycles as BET protein inhibitors BRD1, BRD3, BRD2 KDM5A 2132/4885POLB 693/4885TSHR 1771/4885

“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.