SCHEMBL11297046

SCHEMBL11297046

Cc1ccc(/N=c2\s[nH]c(=O)n2Cc2cccc(C#N)c2)cc1Cl

nearest known ligand 0.40

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
GRIN1 Q05586 4/20 0.40
GRIN2B Q13224 4/20 0.40
BRD4 O60885 1/20 0.40
CCR2 P41597 1/20 0.38
CLPP Q16740 1/20 0.38
PDE4D Q08499 1/20 0.38
PDE7A Q13946 1/20 0.38
PDE3A Q14432 1/20 0.38
FEN1 P39748 1/20 0.38
DRD4 P21917 1/20 0.37
PIK3R1 P27986 3/20 0.37
PIK3CA P42336 3/20 0.37
ROCK2 O75116 1/20 0.37
MAPT P10636 1/20 0.36
ADRA1D P25100 1/20 0.36
P2RX7 Q99572 1/20 0.35
KMT2A Q03164 1/20 0.35
KLKB1 P03952 1/20 0.35
KLK1 P06870 1/20 0.35

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
SCHEMBL12961074 0.91 GRIN1 (0.42) GRIN1GRIN2BBRD4CCR2CLPP
SCHEMBL11297037 0.85 KDM4E (0.41) GRIN1GRIN2BMAPTKMT2A
SCHEMBL11298571 0.82 CCR2 (0.39) CCR2MAPTKMT2A
SCHEMBL11297042 0.80 BRD4 (0.44) BRD4FEN1MAPTKMT2A
SCHEMBL11297623 0.79 MAPT (0.44) MAPTKMT2A
SCHEMBL11300105 0.77 ADORA2B (0.41) MAPTKMT2A
SCHEMBL11297039 0.76 RGS4 (0.44) CCR2MAPTKMT2A
SCHEMBL1051364 0.75 IDO1 (0.40) GRIN1GRIN2BFEN1MAPTKMT2A
SCHEMBL1051365 0.75 IDO1 (0.40) GRIN1GRIN2BFEN1MAPTKMT2A
SCHEMBL11298716 0.73 CYP11B2 (0.38) CCR2MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9675596-B2 1,2,4-thiazolidin-3-one derivatives and their use in the treatment of cancer BALTIC BIO AB (SE) 2017-06-13 US disclosed
US-20160128993-A1 1,2,4-THIAZOLIDIN-3-ONE DERIVATIVES AND THEIR USE IN THE TREATMENT OF CANCER BALTICGRUPPEN BIO AB (SE) 2016-05-12 US disclosed
US-9162994-B2 1,2,4-thiazoloidin-3-one derivatives and their use in the treatment of cancer BETAGENON AB (SE) 2015-10-20 US disclosed
US-20120183537-A1 1,2,4-THIAZOLOIDIN-3-ONE DERIVATIVES AND THEIR USE IN THE TREATMENT OF CANCER BETAGENON AB 2012-07-19 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 (2 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-20160128993-A1 1,2,4-THIAZOLIDIN-3-ONE DERIVATIVES AND THEIR USE IN THE TREATMENT OF CANCER HCCS, CCND3, MTNR1A GRIN1 3517/4885GRIN2B 3939/4885BRD4 131/4885
US-20120183537-A1 1,2,4-THIAZOLOIDIN-3-ONE DERIVATIVES AND THEIR USE IN THE TREATMENT OF CANCER HCCS, CCND3, MTNR1A GRIN1 3686/4885GRIN2B 4127/4885BRD4 209/4885

“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.