SCHEMBL5263474

SCHEMBL5263474

O=C(O)c1n[nH]c2c1CNCC2

nearest known ligand 0.61

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
HCAR2 Q8TDS4 10/20 0.61
KMT2A Q03164 1/20 0.61
TSHR P16473 1/20 0.59
SOS1 Q07889 1/20 0.43
RBP4 P02753 1/20 0.42

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
Hydrochloric Acid SCHEMBL22615346 0.98 HCAR2 (0.59) HCAR2KMT2ATSHRSOS1RBP4
SCHEMBL16127970 0.86 HCAR2 (0.61) HCAR2KMT2ATSHRRBP4
SCHEMBL14520684 0.84 HCAR2 (0.42) HCAR2KMT2ATSHRSOS1RBP4
SCHEMBL4761168 0.84 HCAR2 (0.42) HCAR2KMT2ATSHRSOS1RBP4
SCHEMBL4946106 0.83 HCAR2 (0.56) HCAR2KMT2ATSHR
Hydrochloric Acid SCHEMBL30587571 0.83 HCAR2 (0.41) HCAR2KMT2ATSHRSOS1RBP4
SCHEMBL4762236 0.80 GAA (0.41) HCAR2KMT2ATSHRSOS1RBP4
SCHEMBL17870524 0.79 RBP4 (0.39) HCAR2KMT2ATSHRSOS1RBP4
SCHEMBL17870536 0.78 RBP4 (0.38) HCAR2KMT2ATSHRSOS1RBP4
SCHEMBL17868694 0.77 SOS1 (0.45) HCAR2KMT2ASOS1RBP4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20220031701-A1 COMPOSITIONS AND METHODS FOR TREATING DISEASES ASSOCIATED WITH UNCONTROLLED INFLAMMATORY RESPONSES SYNKRINO BIOTHERAPEUTICS, INC. 2022-02-03 US disclosed
US-11147815-B2 Compositions and methods for treating diseases associated with uncontrolled inflammatory responses SYNKRINO BIOTHERAPEUTICS, INC. 2021-10-19 US disclosed
US-10556904-B2 Derivatives and methods of treating hepatitis B infections NOVIRA THERAPEUTICS, INC. (US) 2020-02-11 US disclosed
US-20190194191-A1 DERIVATIVES AND METHODS OF TREATING HEPATITIS B INFECTIONS NOVIRA THERAPEUTICS, INC. 2019-06-27 US disclosed
US-10189835-B2 Derivatives and methods of treating hepatitis B infections NOVIRA THERAPEUTICS, INC. (US) 2019-01-29 US disclosed
US-20180127415-A1 DERIVATIVES AND METHODS OF TREATING HEPATITIS B INFECTIONS NOVIRA THERAPEUTICS, INC. 2018-05-10 US disclosed
US-20170121329-A1 DERIVATIVES AND METHODS OF TREATING HEPATITIS B INFECTIONS NOVIRA THERAPEUTICS, INC. 2017-05-04 US disclosed
EP-3036230-A1 ALKYNYL ALCOHOLS AND METHODS OF USE F. Hoffmann-La Roche AG (CH) 2016-06-29 EP disclosed
WO-2015025025-A1 ALKYNYL ALCOHOLS AND METHODS OF USE F. HOFFMANN-LA ROCHE AG (CH) 2015-02-26 WO disclosed
EP-1804791-A1 TETRAHYDRO PYRIDINYL PYRAZOLE CANNABINOID MODULATORS JANSSEN PHARMACEUTICA N.V. (BE) 2007-07-11 EP disclosed
WO-2006049880-A1 TETRAHYDRO PYRIDINYL PYRAZOLE CANNABINOID MODULATORS JANSSEN PHARMACEUTICA, N.V. (BE) 2006-05-11 WO disclosed
US-20060089378-A1 Tetrahydro-pyridinyl pyrazole cannabinoid modulators JANSSEN PHARMACEUTICA, N.V. (BE) 2006-04-27 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 (8 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-10189835-B2 Derivatives and methods of treating hepatitis B infections HAVCR2, PYGL, HCCS HCAR2 1517/4885KMT2A 4148/4885TSHR 3754/4885
US-11147815-B2 Compositions and methods for treating diseases associated with uncontrolled inflammatory responses TRIM28, TRIM58, CD14 HCAR2 1509/4885KMT2A 1312/4885TSHR 4389/4885
US-20170121329-A1 DERIVATIVES AND METHODS OF TREATING HEPATITIS B INFECTIONS HAVCR2, PYGL, HCCS HCAR2 1517/4885KMT2A 4148/4885TSHR 3754/4885
US-10556904-B2 Derivatives and methods of treating hepatitis B infections HAVCR2, PYGL, HCCS HCAR2 1517/4885KMT2A 4148/4885TSHR 3754/4885
US-20060089378-A1 Tetrahydro-pyridinyl pyrazole cannabinoid modulators CNR2, CNR1, GPR18 HCAR2 183/4885KMT2A 2839/4885TSHR 1297/4885
US-20180127415-A1 DERIVATIVES AND METHODS OF TREATING HEPATITIS B INFECTIONS HAVCR2, PYGL, HCCS HCAR2 1517/4885KMT2A 4148/4885TSHR 3754/4885
US-20190194191-A1 DERIVATIVES AND METHODS OF TREATING HEPATITIS B INFECTIONS HAVCR2, PYGL, HCCS HCAR2 1517/4885KMT2A 4148/4885TSHR 3754/4885
US-20220031701-A1 COMPOSITIONS AND METHODS FOR TREATING DISEASES ASSOCIATED WITH UNCONTROLLED INFLAMMATORY RESPONSES TRIM28, TRIM58, CD14 HCAR2 1509/4885KMT2A 1312/4885TSHR 4389/4885

“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.