SCHEMBL10167973

SCHEMBL10167973

CNC(=O)c1cnc(Cl)nc1Cl

nearest known ligand 0.52

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
NFKB1 P19838 13/20 0.52
JUN P05412 6/20 0.52
NFKB2 Q00653 6/20 0.52
RELA Q04206 6/20 0.52
ATF1 P18846 8/20 0.40
XPO1 O14980 4/20 0.40
CASP1 P29466 1/20 0.39
ULK1 O75385 1/20 0.38
PLK1 P53350 1/20 0.37
NNMT P40261 1/20 0.37

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
SCHEMBL30498347 0.88 NFKB1 (0.49) NFKB1JUNNFKB2RELAATF1
SCHEMBL5570021 0.83 NFKB1 (0.54) NFKB1JUNNFKB2RELAATF1
SCHEMBL6643357 0.81 NFKB1 (0.49) NFKB1JUNNFKB2RELAATF1
SCHEMBL4768472 0.81 NFKB1 (0.52) NFKB1JUNNFKB2RELAATF1
SCHEMBL1320432 0.79 NFKB1 (0.49) NFKB1JUNNFKB2RELAATF1
SCHEMBL30110408 0.78 NFKB1 (0.46) NFKB1JUNNFKB2RELAATF1
SCHEMBL1602748 0.78 NFKB1 (0.46) NFKB1JUNNFKB2RELAATF1
SCHEMBL17681993 0.77 NFKB1 (0.49) NFKB1JUNNFKB2RELAATF1
SCHEMBL429969 0.76 NFKB1 (0.46) NFKB1JUNNFKB2RELAATF1
SCHEMBL31469871 0.76 NFKB1 (0.46) NFKB1JUNNFKB2RELAATF1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20250257051-A1 SUBSTITUTED PYRIMIDINE COMPOUNDS AS TYK2 INHIBITORS 1910 GENETICS INC (US) 2025-08-14 US disclosed
US-20250115597-A1 TYK2 INHIBITORS AND COMPOSITIONS AND METHODS THEREOF LYNK PHARMACEUTICALS CO LTD (CN) 2025-04-10 US disclosed
US-12129250-B2 TYK2 inhibitors and compositions and methods thereof LYNK PHARMACEUTICALS CO. LTD. (CN) 2024-10-29 US disclosed
EP-4448514-A1 TYK2 INHIBITORS AND COMPOSITIONS AND METHODS THEREOF Lynk Pharmaceuticals Co. Ltd. (CN) 2024-10-23 EP disclosed
US-20240124448-A1 TYK2 INHIBITORS AND COMPOSITIONS AND METHODS THEREOF LYNK PHARMACEUTICALS CO. LTD. (CN) 2024-04-18 US disclosed
WO-2024026430-A1 SUBSTITUTED PYRIMIDINE COMPOUNDS AS TYK2 INHIBITORS 1910 GENETICS INC. (US) 2024-02-01 WO disclosed
US-11780801-B2 Methods of synthesis of (1R,2R,5R)-5-amino-2-methyl-cyclohexanol hydrochloride and intermediates useful therein CELGENE CORPORATION (US) 2023-10-10 US disclosed
WO-2023108536-A1 TYK2 INHIBITORS AND COMPOSITIONS AND METHODS THEREOF LYNK PHARMACEUTICALS CO. LTD. (CN) 2023-06-22 WO disclosed
WO-2023109954-A1 TYK2 INHIBITORS AND COMPOSITIONS AND METHODS THEREOF LYNK PHARMACEUTICALS CO. LTD. (CN) 2023-06-22 WO disclosed
WO-2023109120-A1 TYK2 INHIBITORS AND COMPOSITIONS AND METHODS THEREOF LYNK PHARMACEUTICALS CO. LTD. (CN) 2023-06-22 WO disclosed
US-9145387-B2 ERK inhibitors and uses thereof CELGENE AVILOMICS RESEARCH, INC. (US) 2015-09-29 US disclosed
US-9145387-B2 ERK inhibitors and uses thereof CELGENE AVILOMICS RESEARCH, INC. (US) 2015-09-29 US disclosed
WO-2014124230-A2 ERK INHIBITORS AND USES THEREOF CELGENE AVILOMICS RESEARCH, INC. (US) 2014-08-14 WO disclosed
WO-2014124230-A2 ERK INHIBITORS AND USES THEREOF CELGENE AVILOMICS RESEARCH, INC. (US) 2014-08-14 WO disclosed
US-20140228322-A1 ERK INHIBITORS AND USES THEREOF CELGENE AVILOMICS RESEARCH, INC. (US) 2014-08-14 US disclosed
US-20140228322-A1 ERK INHIBITORS AND USES THEREOF CELGENE AVILOMICS RESEARCH, INC. (US) 2014-08-14 US disclosed
US-20140228322-A1 ERK INHIBITORS AND USES THEREOF CELGENE AVILOMICS RESEARCH, INC. (US) 2014-08-14 US disclosed
WO-2012059507-A1 PYRROLIDINE DERIVATIVES USED AS CATHEPSIN INHIBITORS F. HOFFMANN-LA ROCHE AG (CH) 2012-05-10 WO disclosed
US-20090209743-A1 COLOURED ORGANOPOLYSILOXANES DYSTAR COLOURS DEUTSCHLAND GMBH (DE) 2009-08-20 US disclosed
US-20090209743-A1 COLOURED ORGANOPOLYSILOXANES DYSTAR COLOURS DEUTSCHLAND GMBH (DE) 2009-08-20 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 (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-20090209743-A1 COLOURED ORGANOPOLYSILOXANES MSR1, ARSA, HBS1L NFKB1 2972/4885JUN 4868/4885NFKB2 2146/4885
US-11780801-B2 Methods of synthesis of (1R,2R,5R)-5-amino-2-methyl-cyclohexanol hydrochloride and intermediates useful therein MAPKAPK2, MAP3K8, MAPK1 NFKB1 933/4885JUN 47/4885NFKB2 1418/4885
US-20240124448-A1 TYK2 INHIBITORS AND COMPOSITIONS AND METHODS THEREOF TYK2, JAK2, JAK1 NFKB1 1884/4885JUN 2243/4885NFKB2 1677/4885
US-20250115597-A1 TYK2 INHIBITORS AND COMPOSITIONS AND METHODS THEREOF TYK2, JAK2, JAK1 NFKB1 1884/4885JUN 2243/4885NFKB2 1677/4885
US-12129250-B2 TYK2 inhibitors and compositions and methods thereof TYK2, JAK2, JAK1 NFKB1 1884/4885JUN 2243/4885NFKB2 1677/4885
US-20250257051-A1 SUBSTITUTED PYRIMIDINE COMPOUNDS AS TYK2 INHIBITORS TYK2, PDXK, JAK1 NFKB1 1372/4885JUN 1566/4885NFKB2 1533/4885
US-20140228322-A1 ERK INHIBITORS AND USES THEREOF MAP3K20, MAP3K1, MAPK3 NFKB1 1659/4885JUN 518/4885NFKB2 1841/4885

“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.