SCHEMBL6763398

SCHEMBL6763398

CCOC(=O)C1C2CCC(C(C)(C)C)CC1C2

nearest known ligand 0.43

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
PPM1B O75688 1/20 0.41
PTPN1 P18031 1/20 0.41
PPP1CC P36873 1/20 0.41
ALDH1A1 P00352 2/20 0.40
MEN1 O00255 2/20 0.40
KMT2A Q03164 2/20 0.40
CYP1A2 P05177 1/20 0.40
CYP2C9 P11712 1/20 0.40
CYP2C19 P33261 1/20 0.40
EPHX2 P34913 1/20 0.35
MAPT P10636 3/20 0.34
FKBP1A P62942 2/20 0.33
KCNH2 Q12809 1/20 0.33

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
SCHEMBL14189733 0.84 PPM1B (0.52) PPM1BPTPN1PPP1CCALDH1A1MEN1
SCHEMBL10050521 0.84 PPM1B (0.52) PPM1BPTPN1PPP1CCALDH1A1MEN1
SCHEMBL9605862 0.84 PPM1B (0.52) PPM1BPTPN1PPP1CCALDH1A1MEN1
SCHEMBL14189734 0.84 PPM1B (0.52) PPM1BPTPN1PPP1CCALDH1A1MEN1
SCHEMBL8400471 0.84 PPM1B (0.52) PPM1BPTPN1PPP1CCALDH1A1MEN1
SCHEMBL3983375 0.81 HSD11B1 (0.43) PPM1BPTPN1PPP1CCALDH1A1MEN1
SCHEMBL19323685 0.78 PPM1B (0.59) PPM1BPTPN1PPP1CCALDH1A1MEN1
SCHEMBL19318639 0.78 PPM1B (0.59) PPM1BPTPN1PPP1CCALDH1A1MEN1
SCHEMBL11241112 0.78 PPM1B (0.59) PPM1BPTPN1PPP1CCALDH1A1MEN1
SCHEMBL21243350 0.77 LIPA (0.41) ALDH1A1MEN1KMT2ACYP1A2CYP2C9

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-20040077617-A1 Fused cycloalkyl amides and acids and their therapeutic applications ABBOTT LABORATORIES 2004-04-22 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-20040077617-A1 Fused cycloalkyl amides and acids and their therapeutic applications GRIN2A, GRIK1, GRIN2B PPM1B 2811/4885PTPN1 4751/4885PPP1CC 3561/4885

“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.