SCHEMBL6312982

SCHEMBL6312982

C[C@]12CCC[C@](C)(C(=O)Cl)C1CC[C@H]1CCCC[C@@H]12

nearest known ligand 0.35

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
PTPN1 P18031 3/20 0.35
PAX8 Q06710 1/20 0.35
F10 P00742 4/20 0.35
MMP2 P08253 1/20 0.34
PTPN2 P17706 1/20 0.34
CDC25B P30305 1/20 0.34
HSD11B1 P28845 2/20 0.34
HSP90AA1 P07900 1/20 0.33
MEN1 O00255 1/20 0.33
POLB P06746 1/20 0.33
KMT2A Q03164 1/20 0.33
CYP2C9 P11712 2/20 0.32
CYP2C19 P33261 1/20 0.32
UGT2B7 P16662 1/20 0.31
RPA1 P27694 2/20 0.31
HIF1A Q16665 1/20 0.31
EPAS1 Q99814 1/20 0.31

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
SCHEMBL160063 0.86 PTPN1 (0.47) PTPN1PAX8F10MMP2PTPN2
SCHEMBL6228232 0.80 PTPN1 (0.35) PTPN1F10MMP2PTPN2CDC25B
SCHEMBL29397485 0.74 PTPN1 (0.44) PTPN1PTPN2MEN1KMT2ACYP2C9
SCHEMBL12372508 0.73 HSD11B1 (0.32) HSD11B1
SCHEMBL24439949 0.72 PTPN1 (0.43) PTPN1PAX8F10MMP2PTPN2
SCHEMBL12547269 0.69 PTPN1 (0.43) PTPN1PAX8F10MMP2PTPN2
SCHEMBL9471834 0.69 PTPN1 (0.43) PTPN1PAX8F10MMP2PTPN2
SCHEMBL336573 0.69 PTPN1 (0.43) PTPN1PAX8F10MMP2PTPN2
SCHEMBL31438077 0.69 PTPN1 (0.43) PTPN1PAX8F10MMP2PTPN2
SCHEMBL678124 0.69 PTPN1 (0.43) PTPN1PAX8F10MMP2PTPN2

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-6908934-B2 Therapeutic compounds for treating dyslipidemic conditions MERCK & CO., INC. (US) 2005-06-21 US disclosed
US-20030125357-A1 Therapeutic compounds for treating dyslipidemic conditions MERCK & CO., INC. 2003-07-03 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-20030125357-A1 Therapeutic compounds for treating dyslipidemic conditions NR1H2, NR1H3, APOB PTPN1 2938/4885PAX8 4825/4885F10 1566/4885

“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.