SCHEMBL18205166

SCHEMBL18205166

CC(NC(=O)O)C(=O)N1CCC2(CC1)CC2

nearest known ligand 0.45

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ CYP2C9 P11712 5/20 0.45
▸ CYP1A2 P05177 4/20 0.45
▸ CYP2D6 P10635 5/20 0.43
▸ CYP2C19 P33261 3/20 0.43
▸ ALDH1A1 P00352 4/20 0.41
▸ CYP3A4 P08684 5/20 0.40
▸ SMN1; SMN2 Q16637 1/20 0.40
▸ CCKBR P32239 1/20 0.37
▸ MEN1 O00255 1/20 0.36
▸ MAPK1 P28482 1/20 0.36
▸ KMT2A Q03164 1/20 0.36
▸ TSHR P16473 1/20 0.35
▸ HIF1A Q16665 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
SCHEMBL27256861 0.84 CYP1A2 (0.44) CYP2C9CYP1A2CYP2D6CYP2C19ALDH1A1
SCHEMBL27469804 0.81 CYP2C9 (0.44) CYP2C9CYP1A2CYP2D6CYP2C19ALDH1A1
SCHEMBL17275494 0.81 HPGD (0.41) ALDH1A1SMN1; SMN2
SCHEMBL4239694 0.81 HPGD (0.41) ALDH1A1SMN1; SMN2
SCHEMBL18205164 0.80 CYP2D6 (0.46) CYP2C9CYP1A2CYP2D6CYP2C19ALDH1A1
SCHEMBL5552024 0.79 MMP1 (0.41) ALDH1A1
SCHEMBL27469778 0.79 CYP1A2 (0.43) CYP2C9CYP1A2CYP2D6CYP2C19ALDH1A1
SCHEMBL27269528 0.79 CYP1A2 (0.43) CYP2C9CYP1A2CYP2D6CYP2C19ALDH1A1
SCHEMBL18212467 0.79 CYP1A2 (0.43) CYP2C9CYP1A2CYP2D6CYP2C19ALDH1A1
SCHEMBL22979670 0.78 HSD17B10 (0.45) CYP1A2CYP2C19ALDH1A1

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
WO-2025085852-A1 COMPOUNDS, COMPOSITIONS, AND METHODS NICO THERAPEUTICS, INC. (US) 2025-04-24 — — WO disclosed
US-20190202795-A1 HISTONE DEACETYLASE INHIBITORS AND COMPOSITIONS AND METHODS OF USE THEREOF CHDI FOUNDATION INC (US) 2019-07-04 — — US disclosed
US-10053434-B2 Histone deacetylase inhibitors and compositions and methods of use thereof CHDI FOUNDATION, INC. (US) 2018-08-21 — — US disclosed
US-20160326124-A1 HISTONE DEACETYLASE INHIBITORS AND COMPOSITIONS AND METHODS OF USE THEREOF CHDI FOUNDATION, INC. 2016-11-10 — — 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 (3 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-20190202795-A1 HISTONE DEACETYLASE INHIBITORS AND COMPOSITIONS AND METHODS OF USE THEREOF HDAC1, HDAC7, HDAC5 CYP2C9 3154/4885CYP1A2 2659/4885CYP2D6 3895/4885
US-10053434-B2 Histone deacetylase inhibitors and compositions and methods of use thereof HDAC1, HDAC7, HDAC5 CYP2C9 3154/4885CYP1A2 2659/4885CYP2D6 3895/4885
US-20160326124-A1 HISTONE DEACETYLASE INHIBITORS AND COMPOSITIONS AND METHODS OF USE THEREOF HDAC1, HDAC7, HDAC5 CYP2C9 3154/4885CYP1A2 2659/4885CYP2D6 3895/4885

“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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