SCHEMBL31089762

SCHEMBL31089762

CCC1CCCCN1C(=O)C(C)Oc1ccc2c(-c3ccccc3Cl)cc(=O)oc2c1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ RAB9A P51151 1/20 0.57
▸ ALDH1A1 P00352 9/20 0.46
▸ HPGD P15428 7/20 0.46
▸ CYP3A4 P08684 1/20 0.46
▸ CYP2C9 P11712 1/20 0.46
▸ CYP2C19 P33261 1/20 0.46
▸ KDM4E B2RXH2 8/20 0.44
▸ KMT2A Q03164 4/20 0.44
▸ MEN1 O00255 1/20 0.44
▸ USP2 O75604 1/20 0.44
▸ TSHR P16473 1/20 0.44
▸ HSD17B10 Q99714 1/20 0.44
▸ CA12 O43570 1/20 0.44
▸ CA9 Q16790 1/20 0.44
▸ HTT P42858 3/20 0.43
▸ MAPT P10636 2/20 0.43
▸ L3MBTL1 Q9Y468 1/20 0.43
▸ RECQL P46063 2/20 0.41
▸ LMNA P02545 1/20 0.40
▸ TP53 P04637 1/20 0.40

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
SCHEMBL30360854 0.91 RAB9A (0.47) RAB9AALDH1A1HPGDCYP3A4CYP2C9
SCHEMBL31089559 0.90 RAB9A (0.61) RAB9AALDH1A1HPGDCYP3A4CYP2C9
SCHEMBL31089757 0.89 RAB9A (0.72) RAB9AALDH1A1HPGDKDM4EKMT2A
SCHEMBL31089750 0.89 RAB9A (0.72) RAB9AALDH1A1HPGDKDM4EKMT2A
SCHEMBL31089736 0.87 RAB9A (0.58) RAB9AALDH1A1HPGDCYP3A4CYP2C9
SCHEMBL20839376 0.84 ALDH1A1 (0.57) RAB9AALDH1A1HPGDCYP3A4CYP2C9
SCHEMBL30058125 0.84 ALDH1A1 (0.57) RAB9AALDH1A1HPGDCYP3A4CYP2C9
SCHEMBL20839060 0.83 ALDH1A1 (0.56) RAB9AALDH1A1HPGDCYP3A4CYP2C9
SCHEMBL20839063 0.83 ALDH1A1 (0.56) RAB9AALDH1A1HPGDCYP3A4CYP2C9
SCHEMBL23777288 0.83 RAB9A (0.61) RAB9AALDH1A1HPGDCYP3A4CYP2C9

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-20240252454-A1 COMPOSITION COMPRISING AN INHIBITOR OF MITOCHONDRIAL TRANSCRIPTION LEAD DISCOVERY CENTER GMBH (DE) 2024-08-01 — — 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-20240252454-A1 COMPOSITION COMPRISING AN INHIBITOR OF MITOCHONDRIAL TRANSCRIPTION TFAM, POLRMT, TUFM RAB9A 4733/4885ALDH1A1 3415/4885HPGD 1853/4885

“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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