SCHEMBL264158

SCHEMBL264158

Cc1cnc(Nc2ccc(OCCN3CCCC3)cc2)nc1Nc1cccc(S(N)(=O)=O)c1

nearest known ligand 0.79

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
JAK3 P52333 15/20 0.79
JAK1 P23458 13/20 0.79
JAK2 O60674 7/20 0.79
BRD4 O60885 7/20 0.79
RET P07949 4/20 0.79
TYK2 P29597 4/20 0.79
FLT3 P36888 4/20 0.79
BTK Q06187 4/20 0.79
SYK P43405 4/20 0.79
EGFR P00533 3/20 0.79
PLK4 O00444 3/20 0.79
CHEK1 O14757 3/20 0.79
AURKA O14965 3/20 0.79
DCLK1 O15075 3/20 0.79
DAPK3 O43293 3/20 0.79
ROCK2 O75116 3/20 0.79
PAK4 O96013 3/20 0.79
ABL1 P00519 3/20 0.79
NTRK1 P04629 3/20 0.79
INSR P06213 3/20 0.79

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
SCHEMBL30381504 1.00 JAK3 (0.79) JAK3JAK1JAK2BRD4RET
SCHEMBL20285974 0.92 JAK2 (0.81) JAK3JAK1JAK2BRD4RET
SCHEMBL28489539 0.92 BRD4 (0.81) JAK3JAK1JAK2BRD4RET
SCHEMBL20330039 0.92 BRD4 (0.82) JAK3JAK1JAK2BRD4RET
SCHEMBL16985210 0.91 BRD4 (0.84) JAK3JAK1JAK2BRD4RET
Fedratinib SCHEMBL29351417 0.89 BRD4 (1.00) JAK3JAK1JAK2BRD4RET
Fedratinib SCHEMBL263741 0.89 BRD4 (1.00) JAK3JAK1JAK2BRD4RET
Fedratinib SCHEMBL2734027 0.88 BRD4 (0.98) JAK3JAK1JAK2BRD4RET
SCHEMBL13868200 0.88 BRD4 (0.79) JAK3JAK1JAK2BRD4RET
Fedratinib SCHEMBL21773035 0.87 BRD4 (0.91) JAK3JAK1JAK2BRD4RET

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3927704-A1 CRYSTALLINE FORMS OF A JAK2 INHIBITOR Impact Biomedicines, Inc. (US) 2021-12-29 EP disclosed
EP-3923948-A1 CRYSTALLINE FORMS OF A JAK2 INHIBITOR Impact Biomedicines, Inc. (US) 2021-12-22 EP disclosed
WO-2020167844-A1 CRYSTALLINE FORMS OF A JAK2 INHIBITOR IMPACT BIOMEDICINES, INC. (US) 2020-08-20 WO disclosed
WO-2020167845-A1 CRYSTALLINE FORMS OF A JAK2 INHIBITOR IMPACT BIOMEDICINES, INC. (US) 2020-08-20 WO disclosed
WO-2019173224-A1 DEUTERATED COMPOUNDS AND CHIMERAS AND USES THEREOF BIOTHERYX, INC. (US) 2019-09-12 WO disclosed
US-10040804-B2 Compounds targeting proteins, compositions, methods, and uses thereof BIOTHERYX, INC. (US) 2018-08-07 US disclosed
EP-1951684-B1 BI-ARYL META-PYRIMIDINE INHIBITORS OF KINASES TARGEGEN INC (US) 2016-07-13 EP disclosed
EP-1951684-B1 BI-ARYL META-PYRIMIDINE INHIBITORS OF KINASES TARGEGEN INC (US) 2016-07-13 EP disclosed
US-8604042-B2 Bi-aryl meta-pyrimidine inhibitors of kinases TARGEGEN, INC. (US) 2013-12-10 US disclosed
US-8138199-B2 Use of bi-aryl meta-pyrimidine inhibitors of kinases TARGEGEN, INC. (US) 2012-03-20 US disclosed
US-7528143-B2 Bi-aryl meta-pyrimidine inhibitors of kinases TARGEGEN, INC. (US) 2009-05-05 US disclosed
US-7528143-B2 Bi-aryl meta-pyrimidine inhibitors of kinases TARGEGEN, INC. (US) 2009-05-05 US disclosed
US-7528143-B2 Bi-aryl meta-pyrimidine inhibitors of kinases TARGEGEN, INC. (US) 2009-05-05 US disclosed
US-20070259904-A1 Bi-aryl meta-pyrimidine inhibitors of kinases TARGEGEN, INC. (US) 2007-11-08 US disclosed
US-20070259904-A1 Bi-aryl meta-pyrimidine inhibitors of kinases TARGEGEN, INC. (US) 2007-11-08 US disclosed
US-20070259904-A1 Bi-aryl meta-pyrimidine inhibitors of kinases TARGEGEN, INC. (US) 2007-11-08 US disclosed
US-20070191405-A1 Bi-aryl meta-pyrimidine inhibitors of kinases TARGEGEN, INC. (US) 2007-08-16 US disclosed
US-20070191405-A1 Bi-aryl meta-pyrimidine inhibitors of kinases TARGEGEN, INC. (US) 2007-08-16 US disclosed
US-20070191405-A1 Bi-aryl meta-pyrimidine inhibitors of kinases TARGEGEN, INC. (US) 2007-08-16 US disclosed
WO-2007053452-A1 BI-ARYL META-PYRIMIDINE INHIBITORS OF KINASES TARGEGEN, INC. (US) 2007-05-10 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 (3 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-20070191405-A1 Bi-aryl meta-pyrimidine inhibitors of kinases JAK2, TYK2, JAK3 JAK3 3/4885JAK1 4/4885JAK2 1/4885
US-20070259904-A1 Bi-aryl meta-pyrimidine inhibitors of kinases JAK2, TYK2, JAK3 JAK3 3/4885JAK1 4/4885JAK2 1/4885
US-10040804-B2 Compounds targeting proteins, compositions, methods, and uses thereof CKS1B, IKZF3, EPAS1 JAK3 231/4885JAK1 39/4885JAK2 1002/4885

“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.