SCHEMBL17217439

SCHEMBL17217439

Cc1ccccc1CO/N=[C]\c1ccc(Br)cc1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOB P27338 1/20 0.36
THRA P10827 1/20 0.33
THRB P10828 1/20 0.33
CYP2D6 P10635 1/20 0.33
CYP2C9 P11712 1/20 0.33
ADRA2A P08913 1/20 0.33
ADRA2B P18089 1/20 0.33
ADRA2C P18825 1/20 0.33
CTBP2 P56545 1/20 0.33
TAAR1 Q96RJ0 2/20 0.33
KMT2A Q03164 1/20 0.32
CDK4 P11802 1/20 0.32
CCND1 P24385 1/20 0.32
KDM4E B2RXH2 1/20 0.32
TP53 P04637 1/20 0.32
POLB P06746 1/20 0.32
MAPT P10636 1/20 0.32
NPC1 O15118 2/20 0.31
RAB9A P51151 2/20 0.31
TSHR P16473 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
SCHEMBL17217441 1.00 MAOB (0.36) MAOBTHRATHRBCYP2D6CYP2C9
SCHEMBL17218492 0.88 MAOB (0.38) MAOBADRA2AADRA2BADRA2CTAAR1
SCHEMBL17218495 0.88 MAOB (0.38) MAOBADRA2AADRA2BADRA2CTAAR1
SCHEMBL17217447 0.87 MAOB (0.40) MAOBTHRATHRBADRA2AADRA2B
SCHEMBL17217446 0.87 MAOB (0.40) MAOBTHRATHRBADRA2AADRA2B
SCHEMBL17215907 0.85 TP53 (0.38) MAOBADRA2AADRA2BADRA2CKMT2A
SCHEMBL17216629 0.85 MAOB (0.36) MAOBADRA2AADRA2BADRA2CTAAR1
SCHEMBL17216631 0.85 MAOB (0.36) MAOBADRA2AADRA2BADRA2CTAAR1
SCHEMBL17215906 0.85 TP53 (0.38) MAOBADRA2AADRA2BADRA2CKMT2A
SCHEMBL17216596 0.85 NPC1 (0.40) MAOBADRA2AADRA2BADRA2CKMT2A

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
EP-2940012-B1 TETRAZOLINONE COMPOUND AND APPLICATIONS THEREOF SUMITOMO CHEMICAL CO (JP) 2019-01-30 EP disclosed
US-9560850-B2 Tetrazolinone compound and use thereof SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2017-02-07 US disclosed
US-20150336908-A1 TETRAZOLINONE COMPOUND AND USE THEREOF SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2015-11-26 US disclosed
EP-2940012-A1 TETRAZOLINONE COMPOUND AND APPLICATIONS THEREOF Sumitomo Chemical Company Limited (JP) 2015-11-04 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-20150336908-A1 TETRAZOLINONE COMPOUND AND USE THEREOF RTN3, CYP51A1, TCOF1 MAOB 3611/4885THRA 44/4885THRB 134/4885

“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.