SCHEMBL340119

SCHEMBL340119

Cc1cnc(Nc2ccc(C(=O)NC3CCC3)cc2)nc1Nc1ccc2oc(=O)[nH]c2c1

nearest known ligand 0.63

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
JAK1 P23458 19/20 0.63
JAK3 P52333 19/20 0.63
JAK2 O60674 10/20 0.61
CYP3A4 P08684 7/20 0.59
CYP1A2 P05177 2/20 0.58
SYK P43405 1/20 0.57
TYK2 P29597 1/20 0.57
BRD4 O60885 1/20 0.55

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
SCHEMBL29610830 1.00 JAK1 (0.63) JAK1JAK3JAK2CYP3A4CYP1A2
Formic Acid SCHEMBL29610396 0.97 JAK1 (0.60) JAK1JAK3JAK2CYP3A4CYP1A2
Formic Acid SCHEMBL340859 0.97 JAK1 (0.60) JAK1JAK3JAK2CYP3A4CYP1A2
SCHEMBL340631 0.97 JAK1 (0.65) JAK1JAK3JAK2CYP3A4CYP1A2
SCHEMBL29609951 0.97 JAK1 (0.65) JAK1JAK3JAK2CYP3A4CYP1A2
Formic Acid SCHEMBL29610290 0.94 JAK1 (0.61) JAK1JAK3JAK2CYP3A4CYP1A2
Formic Acid SCHEMBL341512 0.94 JAK1 (0.61) JAK1JAK3JAK2CYP3A4CYP1A2
SCHEMBL29609807 0.93 JAK1 (0.60) JAK1JAK3JAK2CYP3A4CYP1A2
SCHEMBL340204 0.93 JAK1 (0.60) JAK1JAK3JAK2CYP3A4CYP1A2
Trifluoroacetic Acid SCHEMBL29610305 0.91 JAK1 (0.61) JAK1JAK3JAK2CYP3A4CYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20220249475-A1 COMPOUNDS AND METHOD FOR TREATING CYTOKINE RELEASE SYNDROME RIGEL PHARMACEUTICALS, INC. (US) 2022-08-11 US claimed
US-20220218705-A1 COMPOUNDS AND METHOD FOR TREATING AUTOIMMUNE DISEASES RIGEL PHARMACEUTICALS, INC. (US) 2022-07-14 US claimed
US-11220496-B2 Compounds and method for treating autoimmune diseases RIGEL PHARMACEUTICALS, INC. (US) 2022-01-11 US claimed
US-20200087293-A1 COMPOUNDS AND METHOD FOR TREATING AUTOIMMUNE DISEASES RIGEL PHARMACEUTICALS, INC. (US) 2020-03-19 US claimed
EP-2948150-A1 COMPOUNDS AND METHODS FOR TREATING INFLAMMATORY BOWEL DISEASES Rigel Pharmaceuticals, Inc. (US) 2015-12-02 EP claimed
EP-2389372-B1 COMPOSITIONS AND METHODS FOR INHIBITION OF THE JAK PATHWAY RIGEL PHARMACEUTICALS INC (US) 2015-09-09 EP claimed
WO-2014116973-A1 COMPOUNDS AND METHODS FOR TREATING INFLAMMATORY BOWEL DISEASES RIGEL PHARMACEUTICALS, INC. (US) 2014-07-31 WO claimed
US-20140213555-A1 COMPOUNDS AND METHOD FOR TREATING AUTOIMMUNE DISEASES RIGEL PHARMACEUTICALS, INC. (US) 2014-07-31 US claimed
EP-2389372-A1 COMPOSITIONS AND METHODS FOR INHIBITION OF THE JAK PATHWAY Rigel Pharmaceuticals, Inc. (US) 2011-11-30 EP claimed
US-8037782-B2 Steering column assembly FUJI KIKO CO., LTD. (JP) 2011-10-18 US claimed
WO-2010085684-A1 COMPOSITIONS AND METHODS FOR INHIBITION OF THE JAK PATHWAY RIGEL PHARMACEUTICALS, INC. (US) 2010-07-29 WO claimed
US-20100190770-A1 COMPOSITIONS AND METHODS FOR INHIBITION OF THE JAK PATHWAY RIGEL PHARMACEUTICALS, INC. (US) 2010-07-29 US claimed
US-20220249475-A1 COMPOUNDS AND METHOD FOR TREATING CYTOKINE RELEASE SYNDROME RIGEL PHARMACEUTICALS, INC. (US) 2022-08-11 US disclosed
US-20220218705-A1 COMPOUNDS AND METHOD FOR TREATING AUTOIMMUNE DISEASES RIGEL PHARMACEUTICALS, INC. (US) 2022-07-14 US disclosed
US-20220218705-A1 COMPOUNDS AND METHOD FOR TREATING AUTOIMMUNE DISEASES RIGEL PHARMACEUTICALS, INC. (US) 2022-07-14 US disclosed
EP-4009974-A1 COMPOUNDS AND METHOD FOR TREATING CYTOKINE RELEASE SYNDROME Rigel Pharmaceuticals, Inc. (US) 2022-06-15 EP disclosed
EP-2389372-A1 COMPOSITIONS AND METHODS FOR INHIBITION OF THE JAK PATHWAY Rigel Pharmaceuticals, Inc. (US) 2011-11-30 EP disclosed
US-8037782-B2 Steering column assembly FUJI KIKO CO., LTD. (JP) 2011-10-18 US disclosed
WO-2010085684-A1 COMPOSITIONS AND METHODS FOR INHIBITION OF THE JAK PATHWAY RIGEL PHARMACEUTICALS, INC. (US) 2010-07-29 WO disclosed
US-20100190770-A1 COMPOSITIONS AND METHODS FOR INHIBITION OF THE JAK PATHWAY RIGEL PHARMACEUTICALS, INC. (US) 2010-07-29 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 (6 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-11220496-B2 Compounds and method for treating autoimmune diseases NR1H2, CNR2, CNR1 JAK1 2860/4885JAK3 2785/4885JAK2 1240/4885
US-20220249475-A1 COMPOUNDS AND METHOD FOR TREATING CYTOKINE RELEASE SYNDROME IRAK1, IRAK3, IRAK2 JAK1 7/4885JAK3 12/4885JAK2 8/4885
US-20220218705-A1 COMPOUNDS AND METHOD FOR TREATING AUTOIMMUNE DISEASES NR1H2, CNR2, CNR1 JAK1 2860/4885JAK3 2785/4885JAK2 1240/4885
US-20100190770-A1 COMPOSITIONS AND METHODS FOR INHIBITION OF THE JAK PATHWAY JAK3, JAK2, JAK1 JAK1 3/4885JAK3 1/4885JAK2 2/4885
US-20200087293-A1 COMPOUNDS AND METHOD FOR TREATING AUTOIMMUNE DISEASES NR1H2, CNR2, CNR1 JAK1 2860/4885JAK3 2785/4885JAK2 1240/4885
US-20140213555-A1 COMPOUNDS AND METHOD FOR TREATING AUTOIMMUNE DISEASES NR1H2, CNR2, CNR1 JAK1 2860/4885JAK3 2785/4885JAK2 1240/4885

“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.