SCHEMBL6034294

SCHEMBL6034294

CCOc1ccccc1CCNCCCCC(=O)c1ccc2c(c1)NC(=O)CO2

nearest known ligand 0.51

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.51
MAPT P10636 3/20 0.49
RXFP1 Q9HBX9 2/20 0.49
SMN1; SMN2 Q16637 2/20 0.48
ALOX15 P16050 1/20 0.48
TSHR P16473 1/20 0.48
TP53 P04637 1/20 0.47
KDM4E B2RXH2 1/20 0.47
NPSR1 Q6W5P4 1/20 0.45
CASP3 P42574 1/20 0.45
SENP7 Q9BQF6 1/20 0.45

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 SCHEMBL4852386 0.99 ALDH1A1 (0.50) ALDH1A1MAPTRXFP1SMN1; SMN2ALOX15
SCHEMBL6035340 0.91 ALDH1A1 (0.51) ALDH1A1MAPTRXFP1SMN1; SMN2ALOX15
Hydrochloric Acid SCHEMBL4861101 0.91 ALDH1A1 (0.50) ALDH1A1MAPTRXFP1SMN1; SMN2ALOX15
SCHEMBL6035081 0.91 ALDH1A1 (0.51) ALDH1A1MAPTRXFP1SMN1; SMN2ALOX15
Hydrochloric Acid SCHEMBL4859060 0.90 ALDH1A1 (0.51) ALDH1A1MAPTRXFP1SMN1; SMN2ALOX15
SCHEMBL6034277 0.86 ALDH1A1 (0.52) ALDH1A1MAPTRXFP1SMN1; SMN2ALOX15
SCHEMBL6035826 0.85 ALDH1A1 (0.60) ALDH1A1MAPTRXFP1KDM4ECASP3
SCHEMBL6035904 0.85 ALDH1A1 (0.56) ALDH1A1MAPTRXFP1TP53KDM4E
Hydrochloric Acid SCHEMBL4856892 0.85 ALDH1A1 (0.51) ALDH1A1MAPTRXFP1SMN1; SMN2ALOX15
SCHEMBL6035104 0.85 ALDH1A1 (0.54) ALDH1A1MAPTRXFP1SMN1; SMN2ALOX15

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 3 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-7462628-B2 Preventives/remedies for urinary disturbance TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2008-12-09 US disclosed
US-20060063769-A1 Preventives/remedies for urinary disturbance TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2006-03-23 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-20060063769-A1 Preventives/remedies for urinary disturbance ACHE, BPHL, CHRM1 ALDH1A1 118/4885MAPT 1965/4885RXFP1 128/4885

“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.