SCHEMBL2728166

SCHEMBL2728166

CC1(C)CN(C(=O)c2ccc(-c3cccc4nc(N)nn34)cc2)C1

nearest known ligand 0.65

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
JAK2 O60674 14/20 0.65
JAK1 P23458 11/20 0.65
JAK3 P52333 4/20 0.65
TYK2 P29597 3/20 0.65
NUDT1 P36639 1/20 0.54
EGLN2 Q96KS0 1/20 0.51

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
SCHEMBL15654465 0.84 JAK2 (0.65) JAK2JAK1JAK3TYK2NUDT1
SCHEMBL15654785 0.82 JAK2 (0.59) JAK2JAK1JAK3TYK2NUDT1
SCHEMBL22511942 0.81 JAK2 (0.71) JAK2JAK1JAK3TYK2
SCHEMBL15652948 0.81 JAK2 (0.68) JAK2JAK1JAK3TYK2NUDT1
SCHEMBL15654412 0.81 JAK1 (0.68) JAK2JAK1JAK3TYK2NUDT1
SCHEMBL3777612 0.81 JAK1 (0.66) JAK2JAK1JAK3TYK2NUDT1
SCHEMBL15654398 0.81 JAK2 (0.68) JAK2JAK1JAK3TYK2NUDT1
SCHEMBL15654621 0.79 JAK1 (0.57) JAK2JAK1JAK3TYK2NUDT1
SCHEMBL15654966 0.79 JAK2 (0.70) JAK2JAK1JAK3TYK2NUDT1
Solcitinib SCHEMBL2240393 0.79 JAK2 (1.00) JAK2JAK1JAK3TYK2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2792677-B1 Novel compound useful for the treatment of degenerative and inflammatory diseases GALAPAGOS NV (BE) 2017-04-26 EP disclosed
US-9505754-B2 Compound useful for the treatment of degenerative and inflammatory diseases GALAPAGOS NV (BE) 2016-11-29 US disclosed
US-9415037-B2 Compounds useful for the treatment of degenerative and inflammatory diseases GALAPAGOS NV (BE) 2016-08-16 US disclosed
US-20150150856-A1 NOVEL COMPOUNDS USEFUL FOR THE TREATMENT OF DEGENERATIVE AND INFLAMMATORY DISEASES ALFASIGMA S.P.A. (IT) 2015-06-04 US disclosed
US-20150031671-A1 NOVEL COMPOUND USEFUL FOR THE TREATMENT OF DEGENERATIVE AND INFLAMMATORY DISEASES GILEAD SCIENCES, INC. 2015-01-29 US disclosed
EP-2792677-A1 Novel compound useful for the treatment of degenerative and inflammatory diseases Galapagos N.V. (BE) 2014-10-22 EP disclosed
US-8853240-B2 Compounds useful for the treatment of degenerative and inflammatory diseases GALAPAGOS NV (BE) 2014-10-07 US disclosed
EP-2445912-B1 NOVEL COMPOUND USEFUL FOR THE TREATMENT OF DEGENERATIVE AND INFLAMMATORY DISEASES GALAPAGOS NV (BE) 2014-08-13 EP disclosed
US-8796457-B2 Compound useful for the treatment of degenerative and inflammatory diseases GALAPAGOS NV (BE) 2014-08-05 US disclosed
EP-2361251-B1 NOVEL COMPOUNDS USEFUL FOR THE TREATMENT OF DEGENERATIVE AND INFLAMMATORY DISEASES GALAPAGOS NV (BE) 2014-04-30 EP disclosed
EP-2445912-A1 NOVEL COMPOUND USEFUL FOR THE TREATMENT OF DEGENERATIVE AND INFLAMMATORY DISEASES Galapagos N.V. (BE) 2012-05-02 EP disclosed
US-20100331359-A1 NOVEL COMPOUND USEFUL FOR THE TREATMENT OF DEGENERATIVE AND INFLAMMATORY DISEASES GILEAD SCIENCES, INC. 2010-12-30 US disclosed
WO-2010149771-A1 NOVEL COMPOUND USEFUL FOR THE TREATMENT OF DEGENERATIVE AND INFLAMMATORY DISEASES GALAPAGOS NV (BE) 2010-12-29 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-20150150856-A1 NOVEL COMPOUNDS USEFUL FOR THE TREATMENT OF DEGENERATIVE AND INFLAMMATORY DISEASES TLR6, TRAF6, BMP6 JAK2 242/4885JAK1 100/4885JAK3 211/4885
US-20100331359-A1 NOVEL COMPOUND USEFUL FOR THE TREATMENT OF DEGENERATIVE AND INFLAMMATORY DISEASES IL6, BMP6, TRAF6 JAK2 401/4885JAK1 274/4885JAK3 552/4885
US-20150031671-A1 NOVEL COMPOUND USEFUL FOR THE TREATMENT OF DEGENERATIVE AND INFLAMMATORY DISEASES IL6, BMP6, TRAF6 JAK2 401/4885JAK1 274/4885JAK3 552/4885

“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.