SCHEMBL6034199

SCHEMBL6034199

CN(CCCCC(=O)c1ccc2c(c1)CN(C)C(=O)N2C)CCc1ccccc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
THRA P10827 1/20 0.46
THRB P10828 1/20 0.46
SIGMAR1 Q99720 7/20 0.41
TMEM97 Q5BJF2 1/20 0.41
TDP1 Q9NUW8 2/20 0.40
KMT2A Q03164 1/20 0.40
NPC1 O15118 1/20 0.40
CASP3 P42574 1/20 0.40
RAB9A P51151 1/20 0.40
SENP8 Q96LD8 1/20 0.40
SENP7 Q9BQF6 1/20 0.40
SENP6 Q9GZR1 1/20 0.40
L3MBTL1 Q9Y468 2/20 0.39
ALDH1A1 P00352 1/20 0.39
LMNA P02545 1/20 0.39
TP53 P04637 1/20 0.39
MAPT P10636 1/20 0.39
KLF5 Q13887 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
DPP4 P27487 1/20 0.39

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
Hydrochloric Acid SCHEMBL4853622 0.99 THRA (0.45) THRATHRBSIGMAR1TMEM97TDP1
SCHEMBL13988069 0.87 KMT2A (0.38) THRATHRBSIGMAR1KMT2AL3MBTL1
SCHEMBL6035073 0.87 MCHR1 (0.38) TDP1KMT2AL3MBTL1LMNAACHE
Hydrochloric Acid SCHEMBL4857673 0.86 MCHR1 (0.38) TDP1KMT2AL3MBTL1LMNAACHE
SCHEMBL6035012 0.85 SIGMAR1 (0.44) SIGMAR1ACHE
Hydrochloric Acid SCHEMBL4861132 0.84 SIGMAR1 (0.43) SIGMAR1ACHE
SCHEMBL27611240 0.80 TSHR (0.35) SIGMAR1TDP1KMT2AL3MBTL1ALDH1A1
SCHEMBL4859534 0.78 BRD4 (0.40) RAB9AL3MBTL1ALDH1A1MAPTSMN1; SMN2
SCHEMBL6035084 0.77 THRA (0.49) THRATHRBSIGMAR1TMEM97NPC1
Hydrochloric Acid SCHEMBL4861422 0.76 THRA (0.48) THRATHRBSIGMAR1TMEM97L3MBTL1

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-20060063769-A1 Preventives/remedies for urinary disturbance TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2006-03-23 US claimed
US-7462628-B2 Preventives/remedies for urinary disturbance TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2008-12-09 US disclosed
US-7462628-B2 Preventives/remedies for urinary disturbance TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2008-12-09 US disclosed
US-7132547-B2 Preventives/remedies for urinary disturbance TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2006-11-07 US disclosed
US-20060063769-A1 Preventives/remedies for urinary disturbance TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2006-03-23 US disclosed
CN-1589153-A Prevention or treatment of urinary disorders TAKEDA CHEMICAL INDUSTRIES LTD (JP) 2005-03-02 CN 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-20060063769-A1 Preventives/remedies for urinary disturbance ACHE, BPHL, CHRM1 THRA 1992/4885THRB 1908/4885SIGMAR1 2780/4885

“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.