SCHEMBL1249539

SCHEMBL1249539

CC(C)(C)OC(=O)N1CSCCC1C(=O)O

nearest known ligand 0.46

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
HSD17B10 Q99714 3/20 0.46
PREP P48147 1/20 0.43
SMN1; SMN2 Q16637 2/20 0.40
ATM Q13315 1/20 0.40
CHRM2 P08172 1/20 0.39
CHRM1 P11229 1/20 0.39
CHRM3 P20309 1/20 0.39
USP2 O75604 1/20 0.38
RECQL P46063 1/20 0.37
HPGD P15428 1/20 0.36
BTK Q06187 1/20 0.36
LMNA P02545 1/20 0.36
CYP2C19 P33261 1/20 0.36

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
SCHEMBL2015867 0.89 PREP (0.42) HSD17B10PREPSMN1; SMN2ATMCHRM2
SCHEMBL202300 0.87 ACE (0.48) HSD17B10PREPSMN1; SMN2ATMCHRM2
SCHEMBL1022969 0.87 ACE (0.48) HSD17B10PREPSMN1; SMN2ATMCHRM2
SCHEMBL202301 0.87 ACE (0.48) HSD17B10PREPSMN1; SMN2ATMCHRM2
SCHEMBL14209868 0.83 PREP (0.43) HSD17B10PREPSMN1; SMN2CHRM2CHRM1
SCHEMBL73360 0.81 HSD17B10 (0.56) HSD17B10SMN1; SMN2CHRM2CHRM1CHRM3
SCHEMBL73359 0.81 HSD17B10 (0.56) HSD17B10SMN1; SMN2CHRM2CHRM1CHRM3
SCHEMBL1631708 0.81 HSD17B10 (0.56) HSD17B10SMN1; SMN2CHRM2CHRM1CHRM3
SCHEMBL6219872 0.78 HSD17B10 (0.69) HSD17B10SMN1; SMN2LMNACYP2C19
SCHEMBL85536 0.78 HSD17B10 (0.69) HSD17B10SMN1; SMN2LMNACYP2C19

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2281818-A1 Fused pyridazine derivative compounds and drugs containing these compounds as the active ingredient ONO PHARMACEUTICAL CO., LTD. (JP) 2011-02-09 EP disclosed
US-20080261947-A1 FUSED PYRIDAZINE DERIVATIVE COMPOUNDS AND DRUGS CONTAINING THESE COMPOUNDS AS THE ACTIVE INGREDIENT ONO PHARMACEUTICAL CO., LTD. 2008-10-23 US disclosed
US-7402580-B2 Fused pyridazine derivative compounds and drugs containing these compounds as the active ingredient ONO PHARMACEUTICAL CO., LTD. (JP) 2008-07-22 US disclosed
US-20050085476-A1 Fused pyridazine derivative compounds and drugs containing the compounds as the active ingredient ONO PHARMACEUTICAL CO., LTD. (JP) 2005-04-21 US disclosed
EP-1477175-A1 FUSED PYRIDAZINE DERIVATIVE COMPOUNDS AND DRUGS CONTAINING THE COMPOUNDS AS THE ACTIVE INGREDIENT ONO PHARMACEUTICAL CO., LTD. (JP) 2004-11-17 EP 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-20050085476-A1 Fused pyridazine derivative compounds and drugs containing the compounds as the active ingredient MUSK, RNASE1, DPYD HSD17B10 3899/4885PREP 1531/4885SMN1; SMN2 8/4885
US-20080261947-A1 FUSED PYRIDAZINE DERIVATIVE COMPOUNDS AND DRUGS CONTAINING THESE COMPOUNDS AS THE ACTIVE INGREDIENT MUSK, RNASE1, DPYD HSD17B10 3892/4885PREP 1502/4885SMN1; SMN2 8/4885

“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.