SCHEMBL4861189

SCHEMBL4861189

COc1ccc(-c2ccc3c(c2)CCN3C(C)=O)cc1CCCN(CCCCC=O)C(=O)OC(C)(C)C

nearest known ligand 0.43

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
TRIM24 O15164 14/20 0.43
CYP11B1 P15538 2/20 0.41
CYP11B2 P19099 2/20 0.41
SMN1; SMN2 Q16637 1/20 0.40
NOTUM Q6P988 1/20 0.39
LMNA P02545 1/20 0.38
BRPF1 P55201 1/20 0.38

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
SCHEMBL4854074 0.97 CYP11B1 (0.41) TRIM24CYP11B1CYP11B2SMN1; SMN2NOTUM
SCHEMBL4858694 0.90 TRIM24 (0.46) TRIM24CYP11B1CYP11B2SMN1; SMN2NOTUM
SCHEMBL4851828 0.87 TRIM24 (0.36) TRIM24CYP11B1CYP11B2LMNA
SCHEMBL4859154 0.87 THRB (0.41) TRIM24CYP11B1CYP11B2LMNA
SCHEMBL4861394 0.87 NOTUM (0.39) CYP11B1CYP11B2NOTUM
SCHEMBL4858572 0.86 CYP11B1 (0.44) TRIM24CYP11B1CYP11B2SMN1; SMN2NOTUM
SCHEMBL4860522 0.86 MEN1 (0.33) TRIM24SMN1; SMN2NOTUM
SCHEMBL4857520 0.85 DGAT1 (0.42) TRIM24SMN1; SMN2
SCHEMBL4858788 0.84 CYP11B1 (0.42) TRIM24CYP11B1CYP11B2SMN1; SMN2NOTUM
SCHEMBL4855336 0.84 S1PR1 (0.38) CYP11B1CYP11B2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7462628-B2 Preventives/remedies for urinary disturbance TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2008-12-09 US disclosed
US-7138533-B2 Preventives/remedies for urinary disturbance TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2006-11-21 US disclosed
US-7132547-B2 Preventives/remedies for urinary disturbance TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2006-11-07 US disclosed
US-20060211675-A1 Preventives/remedies for urinary disturbance ISHIHARA YUJI 2006-09-21 US disclosed
US-20060063769-A1 Preventives/remedies for urinary disturbance TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2006-03-23 US disclosed
US-20050197362-A1 Preventives/remedies for urinary disturbance TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2005-09-08 US disclosed
EP-1466625-A1 PREVENTIVES/REMEDIES FOR URINARY DISTURBANCE Takeda Chemical Industries, Ltd. (JP) 2004-10-13 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 (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-20060063769-A1 Preventives/remedies for urinary disturbance ACHE, BPHL, CHRM1 TRIM24 2031/4885CYP11B1 615/4885CYP11B2 872/4885
US-20050197362-A1 Preventives/remedies for urinary disturbance ACHE, BPHL, CHRM1 TRIM24 2031/4885CYP11B1 615/4885CYP11B2 872/4885
US-20060211675-A1 Preventives/remedies for urinary disturbance ACHE, BPHL, ACE TRIM24 2922/4885CYP11B1 698/4885CYP11B2 655/4885

“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.