SCHEMBL19001032

SCHEMBL19001032

CC1CN(c2ccc(C(C)(C)C)cc2)CC(C)N1C(=O)c1ccccn1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PLA2G1B P04054 1/20 0.51
ATG4B Q9Y4P1 1/20 0.51
RBP4 P02753 4/20 0.47
HSD11B1 P28845 2/20 0.43
AGTR1 P30556 1/20 0.43
L3MBTL1 Q9Y468 2/20 0.43
SMN1; SMN2 Q16637 2/20 0.43
NPC1 O15118 2/20 0.42
RAB9A P51151 2/20 0.42
KLF5 Q13887 2/20 0.42
GAA P10253 1/20 0.42
ABL1 P00519 1/20 0.42
BCR P11274 1/20 0.42
TNF P01375 1/20 0.42
NOD2 Q9HC29 1/20 0.42
NOD1 Q9Y239 1/20 0.42
CHRNB2 P17787 1/20 0.41
CHRNB4 P30926 1/20 0.41
CHRNA3 P32297 1/20 0.41
CHRNA7 P36544 1/20 0.41

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
SCHEMBL19001092 1.00 PLA2G1B (0.51) PLA2G1BATG4BRBP4HSD11B1AGTR1
SCHEMBL19012370 0.86 SMN1; SMN2 (0.50) RBP4HSD11B1L3MBTL1SMN1; SMN2NPC1
SCHEMBL18436805 0.86 SMN1; SMN2 (0.50) RBP4HSD11B1L3MBTL1SMN1; SMN2NPC1
SCHEMBL18436657 0.85 HSD11B1 (0.45) PLA2G1BATG4BRBP4HSD11B1L3MBTL1
SCHEMBL18436815 0.83 CSF1R (0.46) RBP4HSD11B1L3MBTL1SMN1; SMN2NPC1
SCHEMBL19012534 0.83 HSD11B1 (0.46) RBP4HSD11B1L3MBTL1SMN1; SMN2NPC1
SCHEMBL19012742 0.83 HSD11B1 (0.46) RBP4HSD11B1L3MBTL1SMN1; SMN2NPC1
SCHEMBL19001088 0.81 MEN1 (0.48) RBP4HSD11B1L3MBTL1SMN1; SMN2NPC1
SCHEMBL19000979 0.81 MEN1 (0.48) RBP4HSD11B1L3MBTL1SMN1; SMN2NPC1
SCHEMBL19000977 0.81 MEN1 (0.48) RBP4HSD11B1L3MBTL1SMN1; SMN2NPC1

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9938292-B2 Quinoline derivatives as SMO inhibitors GUANGDONG ZHONGSHENG PHARMACEUTICAL CO., LTD (CN) 2018-04-10 US disclosed
US-9938292-B2 Quinoline derivatives as SMO inhibitors GUANGDONG ZHONGSHENG PHARMACEUTICAL CO., LTD (CN) 2018-04-10 US disclosed
US-20170174703-A1 QUINOLINE DERIVATIVES AS SMO INHIBITORS GUANGDONG ZHONGSHENG PHARMACEUTICAL CO., LTD (CN) 2017-06-22 US disclosed
US-20170174703-A1 QUINOLINE DERIVATIVES AS SMO INHIBITORS GUANGDONG ZHONGSHENG PHARMACEUTICAL CO., LTD (CN) 2017-06-22 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-20170174703-A1 QUINOLINE DERIVATIVES AS SMO INHIBITORS SMO, GLI1, SHH PLA2G1B 2936/4885ATG4B 477/4885RBP4 2117/4885

“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.