SCHEMBL21718924

SCHEMBL21718924

COCCOc1cc(F)c(C(C)(C)C)c(F)c1

nearest known ligand 0.35

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
SYK P43405 1/20 0.35
FFAR1 O14842 2/20 0.33
KDR P35968 2/20 0.32
FGFR1 P11362 1/20 0.32
FLT1 P17948 1/20 0.32
TAAR1 Q96RJ0 1/20 0.32
BRD4 O60885 1/20 0.31
CCL2 P13500 1/20 0.31
CNR1 P21554 1/20 0.31
PDE2A O00408 1/20 0.31
KDM4E B2RXH2 1/20 0.31
HPGD P15428 1/20 0.31
CBFB Q13951 1/20 0.30
MAOA P21397 1/20 0.30
DYRK1A Q13627 1/20 0.30
NR4A2 P43354 1/20 0.30
DHODH Q02127 1/20 0.30

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
SCHEMBL21718780 0.83 TAAR1 (0.32) TAAR1
SCHEMBL1683349 0.83 SMN1; SMN2 (0.41) TAAR1DYRK1A
SCHEMBL21718391 0.79 NQO1 (0.41) FGFR1
SCHEMBL8256480 0.79 SYK (0.38) SYKFFAR1KDRFGFR1FLT1
SCHEMBL21718946 0.77 BRD4 (0.40) SYKFFAR1KDRFGFR1FLT1
SCHEMBL17431922 0.77 SYK (0.37) SYKFFAR1KDRFGFR1FLT1
SCHEMBL10202032 0.76 TAAR1 (0.47) TAAR1KDM4EHPGD
SCHEMBL21718923 0.76 MAPT (0.50) PDE2AKDM4E
SCHEMBL12733585 0.75 F2R (0.36) KDM4E
SCHEMBL21718776 0.74 TAAR1 (0.32) TAAR1

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
US-11178870-B2 Pyridone compounds and agricultural and horticultural fungicides containing the same as active ingredients MITSUI CHEMICALS AGRO, INC. (JP) 2021-11-23 US disclosed
US-11117863-B2 Pyridone compounds and agricultural and horticultural fungicides containing the same as active ingredients MITSUI CHEMICALS AGRO, INC. (JP) 2021-09-14 US disclosed
US-20200172486-A1 PYRIDONE COMPOUNDS AND AGRICULTURAL AND HORTICULTURAL FUNGICIDES CONTAINING THE SAME AS ACTIVE INGREDIENTS MITSUI CHEMICALS AGRO, INC. (JP) 2020-06-04 US disclosed
US-20200045968-A1 PYRIDONE COMPOUNDS AND AGRICULTURAL AND HORTICULTURAL FUNGICIDES CONTAINING THE SAME AS ACTIVE INGREDIENTS MITSUI CHEMICALS AGRO, INC. (JP) 2020-02-13 US 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-20200172486-A1 PYRIDONE COMPOUNDS AND AGRICULTURAL AND HORTICULTURAL FUNGICIDES CONTAINING THE SAME AS ACTIVE INGREDIENTS PNPO, CBR3, CBR1 SYK 1667/4885FFAR1 1787/4885KDR 3703/4885
US-11178870-B2 Pyridone compounds and agricultural and horticultural fungicides containing the same as active ingredients PNPO, CYP4X1, PDXK SYK 2538/4885FFAR1 2071/4885KDR 3405/4885
US-20200045968-A1 PYRIDONE COMPOUNDS AND AGRICULTURAL AND HORTICULTURAL FUNGICIDES CONTAINING THE SAME AS ACTIVE INGREDIENTS PNPO, CYP4X1, PDXK SYK 2538/4885FFAR1 2071/4885KDR 3405/4885
US-11117863-B2 Pyridone compounds and agricultural and horticultural fungicides containing the same as active ingredients PNPO, CBR3, CBR1 SYK 1667/4885FFAR1 1787/4885KDR 3703/4885

“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.