SCHEMBL29678126

SCHEMBL29678126

Cc1cccc(OC(=O)[C@@H](N)CCCCN)c1C

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ POLB P06746 1/20 0.42
▸ DPP8 Q6V1X1 1/20 0.40
▸ DPP9 Q86TI2 1/20 0.40
▸ DPP7 Q9UHL4 1/20 0.40
▸ GSR P00390 1/20 0.39
▸ MEN1 O00255 3/20 0.39
▸ KMT2A Q03164 3/20 0.39
▸ ALDH1A1 P00352 1/20 0.39
▸ CYP1A2 P05177 1/20 0.39
▸ CYP3A4 P08684 1/20 0.39
▸ GAA P10253 1/20 0.39
▸ CYP2C9 P11712 1/20 0.39
▸ CYP2C19 P33261 1/20 0.39
▸ MAPT P10636 3/20 0.39
▸ TDP1 Q9NUW8 1/20 0.37
▸ MMP2 P08253 1/20 0.37
▸ ARF6 P62330 2/20 0.37
▸ LTA4H P09960 1/20 0.36
▸ MAPK1 P28482 1/20 0.36
▸ PTGES O14684 1/20 0.36

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
SCHEMBL9643351 0.79 GSR (0.46) POLBDPP8DPP9DPP7GSR
SCHEMBL28333292 0.78 PPARA (0.39) DPP8DPP9DPP7GSRARF6
SCHEMBL13342807 0.77 MEN1 (0.45) POLBMEN1KMT2AALDH1A1CYP1A2
SCHEMBL8039285 0.77 DPP7 (0.44) DPP8DPP9DPP7GSRMEN1
SCHEMBL19625925 0.77 KDM4E (0.49) DPP8DPP9DPP7GSRMEN1
Hydrochloric Acid SCHEMBL5064601 0.75 LMNA (0.48) DPP8DPP9DPP7GSRKMT2A
Aspirin SCHEMBL4094496 0.74 KDM4E (0.58) DPP8DPP9DPP7GSRMEN1
SCHEMBL28311048 0.74 KDM4E (0.41) DPP8DPP9DPP7GSRMEN1
SCHEMBL2678242 0.74 SCN5A (0.43) DPP8DPP9DPP7GSR
SCHEMBL10241523 0.74 SCN5A (0.43) DPP8DPP9DPP7GSR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3795561-B1 METHOD FOR PRODUCING CARBAMATE AND METHOD FOR PRODUCING ISOCYANATE ASAHI CHEMICAL IND (JP) 2024-11-06 — — EP disclosed
US-11352319-B2 Method for producing carbamate and method for producing isocyanate ASAHI KASEI KABUSHIKI KAISHA (JP) 2022-06-07 — — 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-11352319-B2 Method for producing carbamate and method for producing isocyanate CPS1, CA7, CA4 POLB 2273/4885DPP8 1156/4885DPP9 1425/4885

“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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