SCHEMBL16690379

SCHEMBL16690379

Cc1ccc(C)c(COc2c(C)cccc2-n2nnn(C)c2=O)c1

nearest known ligand 0.36

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.36
TP53 P04637 4/20 0.36
LMNA P02545 4/20 0.36
TSHR P16473 5/20 0.34
NPSR1 Q6W5P4 1/20 0.34
KDM4E B2RXH2 1/20 0.34
HTT P42858 1/20 0.34
THRB P10828 2/20 0.34
MEN1 O00255 2/20 0.33
KMT2A Q03164 2/20 0.33
KDM5A P29375 2/20 0.33
KDM4C Q9H3R0 2/20 0.33
KDM5B Q9UGL1 2/20 0.33
KDM4A O75164 1/20 0.33
KDM2B Q8NHM5 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.32
ALDH1A1 P00352 1/20 0.31

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
SCHEMBL16690383 0.88 NOTUM (0.38) MAPTHTTTHRB
SCHEMBL16690429 0.85 MAOB (0.45) THRB
SCHEMBL16690361 0.85 KDM5A (0.35) MAPTTP53TSHRKDM4EMEN1
SCHEMBL16690349 0.85 NPC1 (0.39) MAPTLMNANPSR1HTTTHRB
SCHEMBL18053069 0.84 THRA (0.35) THRBKDM5AKDM4CKDM5B
SCHEMBL18053070 0.84 KDM5A (0.34) MAPTTP53KDM5AKDM4CKDM5B
SCHEMBL16690411 0.84 KDM4A (0.33) KDM5AKDM4CKDM5BKDM4AKDM2B
SCHEMBL16690415 0.83 P2RX3 (0.34)
SCHEMBL16690345 0.82 KDM4C (0.43) KDM4ETHRBKDM5AKDM4CKDM5B
SCHEMBL18053079 0.81 KDM5A (0.37) KDM4EKDM5AKDM4CKDM5BKDM4A

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
US-20160249617-A1 TETRAZOLINONE COMPOUND AND USE THEREOF SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2016-09-01 US disclosed
US-20160249617-A1 TETRAZOLINONE COMPOUND AND USE THEREOF SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2016-09-01 US disclosed
WO-2015064727-A1 TETRAZOLINONE COMPOUND AND APPLICATION FOR SAME 住友化学株式会社 2015-05-07 WO 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-20160249617-A1 TETRAZOLINONE COMPOUND AND USE THEREOF TCOF1, TAOK2, CYC1 MAPT 4430/4885TP53 4149/4885LMNA 3627/4885

“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.