SCHEMBL6080130

SCHEMBL6080130

COCC12CN(S(=O)(=O)c3coc4cc(Cl)ccc4c3=O)CC(=O)N1CC1(CCN(Cc3ccccc3)CC1)O2

nearest known ligand 0.39

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.39
HSD17B10 Q99714 1/20 0.39
TRPV4 Q9HBA0 1/20 0.38
HTR1A P08908 3/20 0.36
HTR7 P34969 3/20 0.36
HTR6 P50406 3/20 0.36
MAOB P27338 4/20 0.35
ACHE P22303 1/20 0.34
SIGMAR1 Q99720 2/20 0.34
TSHR P16473 1/20 0.34
MAPT P10636 1/20 0.34
RAB9A P51151 1/20 0.33
PKM P14618 1/20 0.33
OPRM1 P35372 1/20 0.33
KDM4E B2RXH2 1/20 0.32

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
SCHEMBL6078359 0.83 ALDH1A1 (0.42) ALDH1A1TRPV4TSHRKDM4E
SCHEMBL4528724 0.81 F10 (0.44)
SCHEMBL4516479 0.80 ALDH1A1 (0.39) ALDH1A1TRPV4HTR6TSHRMAPT
SCHEMBL6080134 0.79 TRPV4 (0.35) ALDH1A1TRPV4SIGMAR1MAPTPKM
SCHEMBL7257489 0.79 LMNA (0.43) ALDH1A1SIGMAR1TSHROPRM1
SCHEMBL6078497 0.77 ALDH1A1 (0.41) ALDH1A1HSD17B10TRPV4HTR1AMAOB
SCHEMBL6079366 0.76 F10 (0.49) ALDH1A1TSHR
SCHEMBL6078643 0.75 F10 (0.41) ALDH1A1TRPV4TSHRKDM4E
SCHEMBL4520059 0.73 CYP2D6 (0.45) ALDH1A1SIGMAR1TSHROPRM1
SCHEMBL6079274 0.73 F10 (0.47) ALDH1A1HSD17B10TRPV4TSHRKDM4E

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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7122662-B2 Tricyclic compound having spiro union MOCHIDA PHARMACEUTICAL CO., LTD. (JP) 2006-10-17 US disclosed
US-20050148769-A1 Tricyclic compound having spiro union MOCHIDA PHARMACEUTICAL CO., LTD. 2005-07-07 US disclosed
US-6858599-B2 Inhibitor for activated blood coagulation factor X MOCHIDA PHARMACEUTICAL CO., LTD. (JP) 2005-02-22 US disclosed
US-20040063716-A1 Cholesterol biosynthesis inhibitors containing as the active ingredient tricyclic spiro compounds MOCHIDA PHARMACEUTICAL CO., LTD. (JP) 2004-04-01 US disclosed
EP-1346994-A1 CHOLESTEROL BIOSYNTHESIS INHIBITORS CONTAINING AS THE ACTIVE INGREDIENT TRICYCLIC SPIRO COMPOUNDS MOCHIDA PHARMACEUTICAL CO., LTD. (JP) 2003-09-24 EP disclosed
US-20030045520-A1 Tricyclic compound having spiro union MOCHIDA PHARMACEUTICAL CO., LTD. (JP) 2003-03-06 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-20040063716-A1 Cholesterol biosynthesis inhibitors containing as the active ingredient tricyclic spiro compounds VKORC1, CYP46A1, TFPI ALDH1A1 1517/4885HSD17B10 70/4885TRPV4 3055/4885
US-20030045520-A1 Tricyclic compound having spiro union F2, TFPI, F11 ALDH1A1 1073/4885HSD17B10 753/4885TRPV4 966/4885
US-20050148769-A1 Tricyclic compound having spiro union TFPI, F2, F12 ALDH1A1 1791/4885HSD17B10 681/4885TRPV4 911/4885

“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.