SCHEMBL17215656

SCHEMBL17215656

CC(C)C=NOCc1ccc(C(F)(F)F)cc1

nearest known ligand 0.47

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
IDO1 P14902 2/20 0.47
MAOB P27338 7/20 0.44
KMT2A Q03164 1/20 0.41
TAAR1 Q96RJ0 1/20 0.41
ALDH1A1 P00352 1/20 0.40
NPC1 O15118 1/20 0.37
RAB9A P51151 1/20 0.37
KDM4E B2RXH2 1/20 0.36
HTT P42858 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
PPARG P37231 1/20 0.36
PPARA Q07869 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
SCHEMBL17216168 0.82 IDO1 (0.53) IDO1MAOBTAAR1HTT
SCHEMBL17219621 0.81 IDO1 (0.42) IDO1MAOBKMT2ATAAR1ALDH1A1
SCHEMBL17219762 0.81 PDE2A (0.40) ALDH1A1
SCHEMBL17217363 0.80 IDO1 (0.50) IDO1MAOBKMT2ATAAR1KDM4E
SCHEMBL17218301 0.80 AGXT (0.44) IDO1MAOBTAAR1ALDH1A1NPC1
SCHEMBL17216686 0.80 TAAR1 (0.36) IDO1KMT2ATAAR1ALDH1A1NPC1
SCHEMBL17218435 0.79 IDO1 (0.49) IDO1MAOBKMT2ATAAR1ALDH1A1
SCHEMBL17219416 0.79 IDO1 (0.37) IDO1KMT2AALDH1A1NPC1RAB9A
SCHEMBL20732769 0.78 L3MBTL1 (0.49) IDO1MAOBKMT2AALDH1A1NPC1
SCHEMBL17215939 0.78 L3MBTL1 (0.49) IDO1MAOBKMT2AALDH1A1NPC1

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 IDO1 2882/4885MAOB 3611/4885KMT2A 2914/4885

“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.