SCHEMBL18436367

SCHEMBL18436367

Cc1ccc(N2CC(C)OC(C)C2)cc1C

nearest known ligand 0.49

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MAPT P10636 6/20 0.49
ADRB1 P08588 1/20 0.49
ALDH1A1 P00352 5/20 0.44
GAA P10253 3/20 0.44
KDM4E B2RXH2 2/20 0.44
RAB9A P51151 1/20 0.44
KMT2A Q03164 3/20 0.40
TSHR P16473 3/20 0.39
SMN1; SMN2 Q16637 2/20 0.39
HSD17B10 Q99714 2/20 0.39
MEN1 O00255 1/20 0.39
CASP1 P29466 1/20 0.39
CYP3A4 P08684 1/20 0.38
CYP2C19 P33261 1/20 0.38
NPSR1 Q6W5P4 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
SCHEMBL18436856 1.00 MAPT (0.49) MAPTADRB1ALDH1A1GAAKDM4E
SCHEMBL18436015 0.84 MAPT (0.45) MAPTADRB1ALDH1A1GAAKDM4E
SCHEMBL18436827 0.84 ALDH1A1 (0.47) MAPTALDH1A1GAAKDM4ERAB9A
SCHEMBL19012716 0.84 ALDH1A1 (0.47) MAPTALDH1A1GAAKDM4ERAB9A
SCHEMBL19012618 0.84 MAPT (0.45) MAPTALDH1A1GAAKDM4ERAB9A
SCHEMBL24865615 0.84 GAA (0.50) MAPTALDH1A1GAAKDM4ERAB9A
SCHEMBL18436857 0.84 MAPT (0.45) MAPTALDH1A1GAAKDM4ERAB9A
SCHEMBL13105566 0.83 MAPT (0.48) MAPTALDH1A1GAAKDM4ERAB9A
SCHEMBL13105532 0.83 MAPT (0.48) MAPTALDH1A1GAAKDM4ERAB9A
SCHEMBL25041817 0.83 MAPT (0.48) MAPTALDH1A1GAAKDM4ERAB9A

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-3124482-B1 QUINOLINE DERIVATIVES AS SMO INHIBITORS GUANGDONG ZHONGSHENG PHARMACEUTICAL CO LTD (CN) 2019-09-11 EP disclosed
US-20170174703-A1 QUINOLINE DERIVATIVES AS SMO INHIBITORS GUANGDONG ZHONGSHENG PHARMACEUTICAL CO., LTD (CN) 2017-06-22 US disclosed
EP-3124482-A1 QUINOLINE DERIVATIVES AS SMO INHIBITORS GUANGDONG ZHONGSHENG PHARMACEUTICAL CO., LTD (CN) 2017-02-01 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-20170174703-A1 QUINOLINE DERIVATIVES AS SMO INHIBITORS SMO, GLI1, SHH MAPT 4195/4885ADRB1 3619/4885ALDH1A1 892/4885

“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.