SCHEMBL16690381

SCHEMBL16690381

Cc1cccc(-n2nnn(C)c2=O)c1OCc1cccc(Oc2ccccc2)c1

nearest known ligand 0.43

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
FFAR1 O14842 9/20 0.43
FFAR4 Q5NUL3 2/20 0.42
ALKBH1 Q13686 1/20 0.40
MTNR1A P48039 1/20 0.37
MTNR1B P49286 1/20 0.37
PKM P14618 2/20 0.37
NPC1 O15118 1/20 0.37
RAB9A P51151 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
FAAH O00519 1/20 0.37
P2RX3 P56373 1/20 0.36
DAO P14920 1/20 0.36
MMP1 P03956 1/20 0.36
MAOA P21397 1/20 0.36
MAOB P27338 1/20 0.36

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
SCHEMBL16690347 0.92 PKM (0.41) FFAR1FFAR4PKMNPC1RAB9A
SCHEMBL16690405 0.89 PKM (0.43) PKMNPC1RAB9ASMN1; SMN2L3MBTL1
SCHEMBL16690380 0.87 MRGPRX4 (0.42) FFAR1FFAR4PKMNPC1RAB9A
SCHEMBL16690429 0.86 MAOB (0.45) FFAR4MAOAMAOB
SCHEMBL16690382 0.83 FFAR1 (0.37) FFAR1FAAHP2RX3
SCHEMBL16690344 0.83 PKM (0.39) PKMNPC1RAB9ASMN1; SMN2L3MBTL1
SCHEMBL16690349 0.81 NPC1 (0.39) PKMNPC1RAB9ASMN1; SMN2L3MBTL1
SCHEMBL16683840 0.81 LMNA (0.41) SMN1; SMN2
SCHEMBL16690383 0.80 NOTUM (0.38) MAOB
SCHEMBL18037164 0.79 MAOB (0.40) PKMNPC1RAB9ASMN1; SMN2L3MBTL1

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 FFAR1 919/4885FFAR4 2970/4885ALKBH1 4060/4885

“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.