SCHEMBL19993432

SCHEMBL19993432

CCSc1c(-c2nc3cc(C(F)(F)F)ncc3n2C)nn2ccccc12

nearest known ligand 0.32

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 1/20 0.32
▸ TGFBR1 P36897 1/20 0.31
▸ PKM P14618 1/20 0.30
▸ LMNA P02545 1/20 0.30
▸ MAPT P10636 1/20 0.30
▸ MYC P01106 1/20 0.30
▸ PDE10A Q9Y233 1/20 0.30
▸ BRD4 O60885 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
SCHEMBL19993248 0.87 JAK2 (0.31) MYC
SCHEMBL19973845 0.84 TGFBR1 (0.33) ALDH1A1TGFBR1PKMPDE10A
SCHEMBL31121688 0.84 TGFBR1 (0.33) ALDH1A1TGFBR1PKMPDE10A
SCHEMBL19993433 0.82 ACSS2 (0.34) TGFBR1
SCHEMBL31121687 0.82 ACSS2 (0.34) TGFBR1
SCHEMBL23956588 0.81 OPRM1 (0.31) TGFBR1
SCHEMBL18819854 0.80 ALDH1A1 (0.33) ALDH1A1PKMPDE10A
SCHEMBL18819764 0.79 ALDH1A1 (0.35) ALDH1A1PKMLMNAMAPT
SCHEMBL18131807 0.79 HSD17B10 (0.33) ALDH1A1PKMMAPT
SCHEMBL30130676 0.78 ENPP1 (0.30) —

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3515921-B1 PYRAZOLO[1,5-A]PYRIDINE DERIVATIVES AND THEIR USE AS PESTICIDES BAYER CROPSCIENCE AG (DE) 2021-10-27 — — EP disclosed
WO-2018050825-A1 PYRAZOLO [1,5-A]PYRIDINE DERIVATIVES AND THEIR USE AS PESTICIDES BAYER CROPSCIENCE AKTIENGESELLSCHAFT (DE) 2018-03-22 — — WO disclosed
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