SCHEMBL13930725

SCHEMBL13930725

Cc1nc(-c2ccc(NC(=O)CC3CCN([C@H](C)CN(c4cccc(F)c4)S(=O)(=O)CC4CCCCC4)CC3)cc2)no1

nearest known ligand 0.40

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 7/20 0.40
▸ MAPT P10636 5/20 0.40
▸ RHOA P61586 1/20 0.39
▸ POLB P06746 1/20 0.38
▸ P2RX3 P56373 1/20 0.37
▸ SIRT2 Q8IXJ6 4/20 0.36
▸ HDAC1 Q13547 1/20 0.36
▸ HDAC8 Q9BY41 1/20 0.36
▸ HDAC6 Q9UBN7 1/20 0.36
▸ NAMPT P43490 1/20 0.35
▸ CTSD P07339 1/20 0.35
▸ RAB9A P51151 1/20 0.34
▸ MAPK1 P28482 1/20 0.34

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
SCHEMBL13930709 0.80 MAPT (0.42) LMNAMAPTRAB9A
SCHEMBL13930708 0.79 MAPT (0.38) LMNAMAPTPOLBNAMPTMAPK1
SCHEMBL13929244 0.74 PKM (0.46) —
SCHEMBL13930773 0.74 OPRM1 (0.38) MAPT
SCHEMBL13929265 0.71 PKM (0.42) HDAC1HDAC6
SCHEMBL13930733 0.71 MAPT (0.38) LMNAMAPT
SCHEMBL13951540 0.70 OGA (0.43) —
SCHEMBL13930731 0.69 EPHX2 (0.44) LMNAMAPTPOLBNAMPTRAB9A
SCHEMBL13952029 0.69 OPRM1 (0.37) LMNAPOLB
SCHEMBL13930681 0.69 OPRM1 (0.37) —

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
US-20090048291-A1 Novel Piperidine-4-Acetic Acid Derivatives and Their Use EUROSCREEN S.A. (BE) 2009-02-19 — — US disclosed
US-20090048291-A1 Novel Piperidine-4-Acetic Acid Derivatives and Their Use EUROSCREEN S.A. (BE) 2009-02-19 — — 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 (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-20090048291-A1 Novel Piperidine-4-Acetic Acid Derivatives and Their Use ALDH1A1, ABAT, ALDH18A1 LMNA 3911/4885MAPT 2479/4885RHOA 3896/4885

“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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