SCHEMBL31692018

SCHEMBL31692018

CC1CN(c2n[nH]c3cc(Cl)ncc23)C1

nearest known ligand 0.41

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ MAPK1 P28482 17/20 0.41
▸ MAPK13 O15264 1/20 0.38
▸ MAPK12 P53778 1/20 0.38
▸ MAPK11 Q15759 1/20 0.38
▸ MAPK14 Q16539 1/20 0.38
▸ MAP2K7 O14733 1/20 0.35
▸ NPC1 O15118 1/20 0.35
▸ ALDH1A1 P00352 1/20 0.35
▸ HPGD P15428 1/20 0.35
▸ RAB9A P51151 1/20 0.35
▸ SMN1; SMN2 Q16637 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
SCHEMBL31691867 0.86 MAPK1 (0.54) MAPK1
SCHEMBL26685790 0.86 CHRNB4 (0.47) MAPK1
SCHEMBL31691847 0.86 MAPK1 (0.39) MAPK1
SCHEMBL31691891 0.86 MAPK1 (0.48) MAPK1
SCHEMBL26685664 0.85 MAPK1 (0.38) MAPK1
SCHEMBL31543302 0.85 MAPK1 (0.40) MAPK1
SCHEMBL31543592 0.85 MAPK1 (0.39) MAPK1
SCHEMBL31543361 0.85 MAPK1 (0.39) MAPK1
SCHEMBL26888619 0.85 HRH4 (0.41) MAPK1
Hydrochloric Acid SCHEMBL31543518 0.84 CHRNB4 (0.46) MAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20250304577-A1 TYK2 INHIBITORS BIOGEN MA INC. 2025-10-02 — — 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 (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-20250304577-A1 TYK2 INHIBITORS TYK2, JAK2, JAK1 MAPK1 228/4885MAPK13 222/4885MAPK12 393/4885

“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.

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