SCHEMBL4153355

SCHEMBL4153355

CN1CCn2c(c([C@@H]3CCCC[C@H]3F)c3ccc(C(=O)O)cc32)-c2ccc(OCc3ccccc3)cc2C1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 4/20 0.39
NPC1 O15118 2/20 0.38
RAB9A P51151 2/20 0.38
POLB P06746 2/20 0.38
GFER P55789 1/20 0.38
PAX8 Q06710 1/20 0.38
KLF5 Q13887 1/20 0.38
MRGPRX4 Q96LA9 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
RXRA P19793 1/20 0.38
RXRB P28702 1/20 0.38
RXRG P48443 1/20 0.38
CYP2D6 P10635 2/20 0.38
KIT P10721 1/20 0.37
FLT3 P36888 1/20 0.37
CHRNB2 P17787 1/20 0.37
CHRNA5 P30532 1/20 0.37
CHRNA7 P36544 1/20 0.37
CHRNA4 P43681 1/20 0.37
MCHR1 Q99705 1/20 0.37

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
SCHEMBL4153354 1.00 HRH3 (0.39) HRH3NPC1RAB9APOLBGFER
SCHEMBL4157401 0.94 NPC1 (0.36) HRH3NPC1RAB9APOLBGFER
SCHEMBL4157400 0.94 NPC1 (0.36) HRH3NPC1RAB9APOLBGFER
SCHEMBL4155762 0.92 PRMT5 (0.37) HRH3NPC1RAB9APOLBGFER
SCHEMBL4155759 0.92 PRMT5 (0.37) HRH3NPC1RAB9APOLBGFER
SCHEMBL4152565 0.91 MTNR1A (0.37) HRH3
SCHEMBL4152561 0.91 MTNR1A (0.37) HRH3
SCHEMBL4143500 0.91 KDM4E (0.40) NPC1RAB9AL3MBTL1
SCHEMBL4143938 0.91 HRH3 (0.41) HRH3NPC1RAB9APOLBGFER
SCHEMBL4143504 0.91 KDM4E (0.40) NPC1RAB9AL3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090136449-A1 Tetracyclic Indole Derivatives as Antiviral Agents ISTITUTO DI RICERCHE DI BIOLOGIA MOLECOLARE P. ANGELETTI SPA (IT) 2009-05-28 US claimed

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-20090136449-A1 Tetracyclic Indole Derivatives as Antiviral Agents IDO1, IDO2, ZC3HAV1 HRH3 811/4885NPC1 1196/4885RAB9A 2854/4885

“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.