SCHEMBL27229142

SCHEMBL27229142

CCSc1ccc([N+](=O)[O-])c(Cl)c1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.58
MAPK1 P28482 1/20 0.58
PDE7A Q13946 4/20 0.56
TDP1 Q9NUW8 1/20 0.46
ALDH1A1 P00352 2/20 0.45
GAA P10253 1/20 0.45
HPGD P15428 1/20 0.45
CA1 P00915 1/20 0.43
CA2 P00918 1/20 0.43
MMP1 P03956 1/20 0.43
MMP2 P08253 1/20 0.43
MMP9 P14780 1/20 0.43
MMP8 P22894 1/20 0.43
MMP13 P45452 1/20 0.43
LMNA P02545 1/20 0.43
CYP1A2 P05177 1/20 0.43
CYP3A4 P08684 1/20 0.43
CYP2D6 P10635 1/20 0.43
MAPT P10636 1/20 0.43
CYP2C9 P11712 1/20 0.43

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
SCHEMBL27229152 0.81 MAPT (0.49) TSHRMAPK1TDP1ALDH1A1HPGD
SCHEMBL29812157 0.81 PDE7A (0.61) TSHRMAPK1PDE7ATDP1ALDH1A1
SCHEMBL9539494 0.81 PDE7A (0.61) TSHRMAPK1PDE7ATDP1ALDH1A1
SCHEMBL11483675 0.80 MAPT (0.54) TSHRMAPK1PDE7ATDP1ALDH1A1
SCHEMBL10784739 0.80 GPR35 (0.51) TSHRMAPK1TDP1ALDH1A1HPGD
SCHEMBL28301045 0.80 IDO1 (0.42) TSHRMAPK1PDE7ATDP1ALDH1A1
SCHEMBL18815092 0.77 TSHR (0.54) TSHRPDE7ATDP1ALDH1A1LMNA
SCHEMBL3953683 0.77 ALDH1A1 (0.51) TSHRMAPK1ALDH1A1HPGDCA1
SCHEMBL11257078 0.76 LMNA (0.49) TSHRMAPK1ALDH1A1HPGDLMNA
SCHEMBL2777612 0.75 PDE7A (0.55) TSHRMAPK1PDE7ATDP1ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4573094-A2 CDK2 INHIBITORS AND USES THEREOF Kymera Therapeutics, Inc. (US) 2025-06-25 EP disclosed
US-20240174665-A1 CDK2 INHIBITORS AND USES THEREOF KYMERA THERAPEUTICS, INC. 2024-05-30 US disclosed
WO-2024039903-A2 CDK2 INHIBITORS AND USES THEREOF KYMERA THERAPEUTICS, INC. (US) 2024-02-22 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 (1 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-20240174665-A1 CDK2 INHIBITORS AND USES THEREOF CDK2, CDK20, CDK1 TSHR 4345/4885MAPK1 1037/4885PDE7A 2870/4885

“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.