SCHEMBL13929453

SCHEMBL13929453

COC(=O)C1CCC(Cc2ccccc2)CC1

nearest known ligand 0.55

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.55
MAPT P10636 2/20 0.55
HPGD P15428 1/20 0.55
NPSR1 Q6W5P4 1/20 0.55
HSD17B10 Q99714 1/20 0.55
MEN1 O00255 4/20 0.49
KMT2A Q03164 4/20 0.49
SMN1; SMN2 Q16637 1/20 0.49
CYP2C9 P11712 1/20 0.49
CYP2C19 P33261 1/20 0.49
MAPK14 Q16539 1/20 0.49
L3MBTL1 Q9Y468 1/20 0.48
FAAH O00519 1/20 0.48
LMNA P02545 1/20 0.47
GAA P10253 1/20 0.47
HTT P42858 1/20 0.47
POLB P06746 1/20 0.47

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
SCHEMBL12404098 1.00 ALDH1A1 (0.55) ALDH1A1MAPTHPGDNPSR1HSD17B10
SCHEMBL11051182 0.92 ALDH1A1 (0.48) ALDH1A1MAPTHPGDNPSR1HSD17B10
SCHEMBL11051190 0.92 ALDH1A1 (0.48) ALDH1A1MAPTHPGDNPSR1HSD17B10
SCHEMBL21494357 0.85 ALDH1A1 (0.49) ALDH1A1MAPTHPGDNPSR1HSD17B10
SCHEMBL5523736 0.84 L3MBTL1 (0.59) ALDH1A1NPSR1MEN1KMT2AL3MBTL1
SCHEMBL5523733 0.84 L3MBTL1 (0.59) ALDH1A1NPSR1MEN1KMT2AL3MBTL1
SCHEMBL16499644 0.84 ALDH1A1 (0.52) ALDH1A1MAPTHPGDNPSR1HSD17B10
SCHEMBL16499815 0.84 ALDH1A1 (0.52) ALDH1A1MAPTHPGDNPSR1HSD17B10
SCHEMBL16499642 0.84 ALDH1A1 (0.52) ALDH1A1MAPTHPGDNPSR1HSD17B10
Benzyl Alcohol SCHEMBL27670531 0.83 ALDH1A1 (0.57) ALDH1A1MAPTHPGDNPSR1HSD17B10

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
US-20250091983-A1 CYCLOPENTANE AND CYCLOHEXANE VARIANTS OF 6-PHENYLHEXANAMIDE MITOFUSIN ACTIVATORS AND METHODS FOR USE THEREOF MITOCHONDRIA EMOTION, INC. (US) 2025-03-20 US disclosed
WO-2023067515-A1 THIADIAZOLYL COMPOUNDS AS DNA POLYMERASE THETA INHIBITORS IDEAYA BIOSCIENCES, INC. (US) 2023-04-27 WO disclosed
WO-2023014828-A2 CYCLOPENTANE AND CYCLOHEXANE VARIANTS OF 6-PHENYLHEXANAMIDE MITOFUSIN ACTIVATORS AND METHODS FOR USE THEREOF MITOCHONDRIA EMOTION, INC. (US) 2023-02-09 WO disclosed
US-20090042900-A1 2,4-DIAMINOQUINAZOLINES FOR SPINAL MUSCULAR ATROPHY DECODE CHEMISTRY, INC. (US) 2009-02-12 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 (2 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-20250091983-A1 CYCLOPENTANE AND CYCLOHEXANE VARIANTS OF 6-PHENYLHEXANAMIDE MITOFUSIN ACTIVATORS AND METHODS FOR USE THEREOF COQ8A, PDF, HAGH ALDH1A1 1211/4885MAPT 1541/4885HPGD 256/4885
US-20090042900-A1 2,4-DIAMINOQUINAZOLINES FOR SPINAL MUSCULAR ATROPHY SMN1; SMN2, MUSK, MYT1 ALDH1A1 1308/4885MAPT 715/4885HPGD 2120/4885

“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.