SCHEMBL16627980

SCHEMBL16627980

Cc1cc(-c2nn(C)c(F)c2C)ccc1O

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSD17B1 P14061 8/20 0.42
HSD17B2 P37059 8/20 0.42
ESR2 Q92731 3/20 0.40
ESR1 P03372 2/20 0.40
PIK3CD O00329 1/20 0.39
ABL1 P00519 1/20 0.39
EGFR P00533 1/20 0.39
HCK P08631 1/20 0.39
SRC P12931 1/20 0.39
KDR P35968 1/20 0.39
PIK3CA P42336 1/20 0.39
PIK3CB P42338 1/20 0.39
MTOR P42345 1/20 0.39
PIK3CG P48736 1/20 0.39
EPHB4 P54760 1/20 0.39
PRKDC P78527 1/20 0.39
PI4KB Q9UBF8 1/20 0.39
AR P10275 2/20 0.39
HSD17B14 Q9BPX1 3/20 0.39
CYP3A4 P08684 2/20 0.38

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
SCHEMBL25923655 0.85 ALDH1A1 (0.38) PIK3CDABL1EGFRHCKSRC
SCHEMBL16627204 0.84 ESR2 (0.42) HSD17B1HSD17B2ESR2ESR1PIK3CD
SCHEMBL16627170 0.81 ESR2 (0.45) HSD17B1HSD17B2ESR2ESR1PIK3CD
SCHEMBL16273639 0.80 ESR2 (0.40) HSD17B1HSD17B2ESR2ESR1PIK3CD
SCHEMBL16273743 0.79 POLB (0.39) HSD17B1HSD17B2ESR2ESR1PIK3CD
SCHEMBL16911354 0.77 ESR2 (0.36) HSD17B1HSD17B2ESR2ESR1PIK3CD
SCHEMBL16911501 0.77 HPGD (0.40) HSD17B1HSD17B2ESR2ESR1PIK3CD
SCHEMBL16628020 0.76 GRM2 (0.39) SRC
SCHEMBL18156169 0.75 MRGPRX4 (0.34) HSD17B1HSD17B2ESR2ESR1PIK3CD
SCHEMBL19987528 0.75 ESR2 (0.38) HSD17B1HSD17B2ESR2ESR1PIK3CD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11046673-B1 Tetrazolinone compounds and its use SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2021-06-29 US disclosed
US-20210179589-A1 TETRAZOLINONE COMPOUNDS AND ITS USE SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2021-06-17 US disclosed
EP-3504199-B1 TETRAZOLINONE COMPOUNDS AND ITS USE SUMITOMO CHEMICAL CO (JP) 2020-06-03 EP disclosed
WO-2018038200-A1 TETRAZOLINONE COMPOUNDS AND ITS USE SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2018-03-01 WO disclosed
US-9788547-B2 Aromatic compound and uses thereof SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2017-10-17 US disclosed
US-9788547-B2 Aromatic compound and uses thereof SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2017-10-17 US disclosed
US-20170105413-A1 AROMATIC COMPOUND AND USES THEREOF SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2017-04-20 US disclosed
US-20170105413-A1 AROMATIC COMPOUND AND USES THEREOF SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2017-04-20 US disclosed
US-9573904-B2 Aromatic compound and use thereof SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2017-02-21 US disclosed
US-9573904-B2 Aromatic compound and use thereof SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2017-02-21 US disclosed
US-20160311775-A1 AROMATIC COMPOUND AND USE THEREOF SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2016-10-27 US disclosed
US-20160311775-A1 AROMATIC COMPOUND AND USE THEREOF SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2016-10-27 US disclosed
WO-2015050040-A1 PLANT DISEASE CONTROL COMPOSITION AND USE THEREOF 住友化学株式会社 2015-04-09 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 (4 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-20210179589-A1 TETRAZOLINONE COMPOUNDS AND ITS USE TTI1, TCOF1, NR1I2 HSD17B1 189/4885HSD17B2 398/4885ESR2 2274/4885
US-11046673-B1 Tetrazolinone compounds and its use TTI1, TCOF1, NR1I2 HSD17B1 189/4885HSD17B2 398/4885ESR2 2274/4885
US-20170105413-A1 AROMATIC COMPOUND AND USES THEREOF TYR, H1-3, H1-0 HSD17B1 2366/4885HSD17B2 2845/4885ESR2 3328/4885
US-20160311775-A1 AROMATIC COMPOUND AND USE THEREOF ZCCHC8, CBR3, CBX8 HSD17B1 3071/4885HSD17B2 3209/4885ESR2 2309/4885

“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.