SCHEMBL5320171

SCHEMBL5320171

CC1CCN(c2cccc(-c3cc[c]cc3)c2)CC1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTR7 P34969 6/20 0.47
HTR1A P08908 4/20 0.47
VCP P55072 2/20 0.42
USP2 O75604 6/20 0.41
HSD17B10 Q99714 4/20 0.41
MAPK1 P28482 3/20 0.41
CYP3A4 P08684 2/20 0.41
CYP1A2 P05177 2/20 0.41
CYP2D6 P10635 2/20 0.41
TSHR P16473 2/20 0.41
ALDH1A1 P00352 1/20 0.41
TP53 P04637 1/20 0.41
SMN1; SMN2 Q16637 2/20 0.41
CYP2C9 P11712 1/20 0.41
HPGD P15428 1/20 0.41
CYP2C19 P33261 1/20 0.41
BRCA1 P38398 1/20 0.39
DHFR P00374 1/20 0.39
MEN1 O00255 2/20 0.39
KMT2A Q03164 2/20 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
SCHEMBL11737413 0.82 HTR7 (0.51) HTR7HTR1AUSP2HSD17B10MAPK1
SCHEMBL3142372 0.79 LMNA (0.50) HTR7HTR1AUSP2HSD17B10MAPK1
SCHEMBL550942 0.77 USP2 (0.55) USP2MAPK1TSHRALDH1A1SMN1; SMN2
SCHEMBL14578437 0.75 ADRA2C (0.62) USP2HSD17B10TSHRALDH1A1SMN1; SMN2
SCHEMBL8054516 0.75 ADRB1 (0.61) HTR7USP2TSHRALDH1A1SMN1; SMN2
SCHEMBL13035710 0.73 BPTF (0.56) USP2TSHRTP53SMN1; SMN2BRCA1
SCHEMBL12367085 0.73 DRD2 (0.64) VCPALDH1A1SMN1; SMN2
SCHEMBL8276471 0.73 L3MBTL3 (0.47) VCPUSP2TSHRALDH1A1BRCA1
SCHEMBL12367104 0.73 PRMT6 (0.46) HTR7VCPUSP2BRCA1
SCHEMBL2093308 0.72 ADRB1 (0.63) HSD17B10MAPK1CYP3A4CYP1A2TSHR

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-20050250784-A1 Inhibitors of histone deacetylase MIIKANA THERAPEUTICS CORPORATION 2005-11-10 US claimed
US-20050197336-A1 Inhibitors of histone deacetylase MIIKANA THERAPEUTICS CORPORATION 2005-09-08 US claimed
EP-1755601-A2 INHIBITORS OF HISTONE DEACETYLASE Miikana Therapeutics, Inc. (US) 2007-02-28 EP disclosed
US-20050250784-A1 Inhibitors of histone deacetylase MIIKANA THERAPEUTICS CORPORATION 2005-11-10 US disclosed
WO-2005086898-A2 INHIBITORS OF HISTONE DEACETYLASE MIIKANA THERAPEUTICS, INC. (US) 2005-09-22 WO disclosed
US-20050197336-A1 Inhibitors of histone deacetylase MIIKANA THERAPEUTICS CORPORATION 2005-09-08 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 (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-20050197336-A1 Inhibitors of histone deacetylase HDAC1, HDAC11, HDAC10 HTR7 2338/4885HTR1A 3714/4885VCP 2325/4885
US-20050250784-A1 Inhibitors of histone deacetylase HDAC1, HDAC11, HDAC10 HTR7 2338/4885HTR1A 3714/4885VCP 2325/4885

“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.