SCHEMBL5380076

SCHEMBL5380076

COCC1(c2ccccc2)CCN(C(=O)O)CC1

nearest known ligand 0.48

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
HSD11B1 P28845 3/20 0.48
TACR1 P25103 6/20 0.48
CHRM5 P08912 3/20 0.46
CHRM1 P11229 3/20 0.46
CHRM3 P20309 3/20 0.46
KCNA3 P22001 1/20 0.46
OPRM1 P35372 1/20 0.44
ALDH1A1 P00352 1/20 0.44
CYP1A2 P05177 1/20 0.44
CYP3A4 P08684 2/20 0.43
CYP2C19 P33261 2/20 0.43
MEN1 O00255 1/20 0.43
MAPK1 P28482 1/20 0.43
KMT2A Q03164 1/20 0.43
USP2 O75604 1/20 0.43
HSD17B10 Q99714 1/20 0.43
CYP2D6 P10635 1/20 0.42
APP P05067 1/20 0.42

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
SCHEMBL17886658 0.85 TACR1 (0.63) HSD11B1TACR1CHRM1CHRM3
SCHEMBL5198260 0.83 TACR1 (0.45) HSD11B1TACR1CHRM5CHRM1CHRM3
SCHEMBL2425376 0.81 HSD11B1 (0.58) HSD11B1TACR1KCNA3OPRM1MEN1
SCHEMBL19402984 0.80 MAOA (0.54) TACR1CHRM5CHRM1CHRM3OPRM1
SCHEMBL23002585 0.80 MAOA (0.61) HSD11B1KCNA3OPRM1MEN1KMT2A
SCHEMBL13059779 0.78 CYP3A4 (0.56) HSD11B1OPRM1ALDH1A1CYP1A2CYP3A4
SCHEMBL3527130 0.77 HSD11B1 (0.42) HSD11B1TACR1KCNA3OPRM1MEN1
SCHEMBL14359682 0.77 DPP4 (0.52) TACR1CHRM1ALDH1A1CYP1A2CYP3A4
SCHEMBL12601480 0.77 TACR1 (0.58) HSD11B1TACR1KCNA3OPRM1ALDH1A1
SCHEMBL17220377 0.76 SCD5 (0.57) HSD11B1OPRM1ALDH1A1CYP1A2CYP3A4

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
EP-1714961-B1 INDAZOLE COMPOUND AND PHARMACEUTICAL USE THEREOF MITSUBISHI TANABE PHARMA CORP (JP) 2015-12-09 EP disclosed
US-20070173537-A1 Indazole compound and pharmaceutical use thereof MITSUBISHI PHARMA CORPORATION (JP) 2007-07-26 US disclosed
EP-1714961-A1 INDAZOLE COMPOUND AND PHARMACEUTICAL USE THEREOF Mitsubishi Pharma Corporation (JP) 2006-10-25 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 (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-20070173537-A1 Indazole compound and pharmaceutical use thereof CYP3A5, CYP3A43, TP53 HSD11B1 137/4885TACR1 2343/4885CHRM5 3382/4885

“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.