SCHEMBL21295265

SCHEMBL21295265

CC1(C)N=C(c2cnc3c(F)cccc3c2)c2ccccc2C1(F)F

nearest known ligand 0.37

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ABCB1 P08183 1/20 0.37
ABCG2 Q9UNQ0 1/20 0.37
KDM4E B2RXH2 4/20 0.34
NPC1 O15118 1/20 0.33
PDK2 Q15119 1/20 0.31
PARP1 P09874 1/20 0.31
ALOX5AP P20292 1/20 0.31
FEN1 P39748 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.30
CASP3 P42574 1/20 0.30
SENP8 Q96LD8 1/20 0.30
SENP7 Q9BQF6 1/20 0.30
SENP6 Q9GZR1 1/20 0.30
GRIN2B Q13224 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
SCHEMBL29368740 1.00 ABCB1 (0.37) ABCB1ABCG2KDM4ENPC1PDK2
SCHEMBL29432957 0.84 ABCB1 (0.39) ABCB1ABCG2KDM4ENPC1PARP1
SCHEMBL4412921 0.84 ABCB1 (0.39) ABCB1ABCG2KDM4ENPC1PARP1
SCHEMBL4408718 0.83 PDGFRB (0.41)
SCHEMBL29353363 0.83 PDGFRB (0.41)
SCHEMBL29352059 0.83 PDGFRB (0.41)
SCHEMBL20521243 0.82 AKR1C3 (0.37)
SCHEMBL23804103 0.81 ABCB1 (0.35) ABCB1ABCG2
SCHEMBL20301217 0.80 NPC1 (0.33) NPC1PDK2
SCHEMBL15911291 0.80 PDGFRB (0.40) NPC1PDK2L3MBTL1CASP3SENP8

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 263 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4384016-B1 ACTIVE COMPOUND COMBINATIONS AND FUNGICIDE COMPOSITIONS COMPRISING THOSE BAYER AG (DE) 2025-09-03 EP claimed
US-20240365785-A1 ACTIVE COMPOUND COMBINATIONS AND FUNGICIDE COMPOSITIONS COMPRISING THOSE BAYER AKTIENGESELLSCHAFT (DE) 2024-11-07 US claimed
EP-4384016-A1 ACTIVE COMPOUND COMBINATIONS AND FUNGICIDE COMPOSITIONS COMPRISING THOSE Bayer Aktiengesellschaft (DE) 2024-06-19 EP claimed
CN-118102874-A Active compound combinations and fungicide compositions comprising them 拜耳公司 2024-05-28 CN claimed
US-20240016152-A1 ACTIVE COMPOUND COMBINATIONS BAYER AKTIENGESELLSCHAFT (DE) 2024-01-18 US claimed
US-20230165252-A1 ACTIVE COMPOUND COMBINATIONS BAYER AKTIENGESELLSCHAFT (DE) 2023-06-01 US claimed
EP-4167740-A1 ACTIVE COMPOUND COMBINATIONS Bayer Aktiengesellschaft (DE) 2023-04-26 EP claimed
CN-115955916-A Active compound combinations 拜耳公司 2023-04-11 CN claimed
EP-4156936-A1 ACTIVE COMPOUND COMBINATIONS Bayer Aktiengesellschaft (DE) 2023-04-05 EP claimed
EP-4135523-A1 ACTIVE COMPOUND COMBINATIONS AND FUNGICIDE COMPOSITIONS COMPRISING THOSE Bayer Aktiengesellschaft (DE) 2023-02-22 EP claimed
WO-2023017120-A1 ACTIVE COMPOUND COMBINATIONS AND FUNGICIDE COMPOSITIONS COMPRISING THOSE BAYER AKTIENGESELLSCHAFT (DE) 2023-02-16 WO claimed
CN-115697059-A Active compound combinations 拜耳公司 2023-02-03 CN claimed
WO-2021255070-A1 ACTIVE COMPOUND COMBINATIONS BAYER AKTIENGESELLSCHAFT (DE) 2021-12-23 WO claimed
WO-2021239766-A1 ACTIVE COMPOUND COMBINATIONS BAYER AKTIENGESELLSCHAFT (DE) 2021-12-02 WO claimed
WO-2021209366-A1 ACTIVE COMPOUND COMBINATIONS AND FUNGICIDE COMPOSITIONS COMPRISING THOSE BAYER AKTIENGESELLSCHAFT (DE) 2021-10-21 WO claimed
WO-2021069707-A1 ACTIVE COMPOUND COMBINATIONS BAYER AKTIENGESELLSCHAFT (DE) 2021-04-15 WO claimed
EP-3679792-A1 ACTIVE COMPOUND COMBINATIONS Bayer AG (DE) 2020-07-15 EP claimed
EP-3669652-A1 ACTIVE COMPOUND COMBINATION Bayer AG (DE) 2020-06-24 EP claimed
US-12612386-B2 Heteroaryl-triazole compounds as pesticides BAYER AKTIENGESELLSCHAFT (DE) 2026-04-28 US disclosed
WO-2019162228-A1 1-(5-SUBSTITUTED IMIDAZOL-1-YL)BUT-3-EN DERIVATIVES AND THEIR USE AS FUNGICIDES BAYER AKTIENGESELLSCHAFT (DE) 2019-08-29 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-12612386-B2 Heteroaryl-triazole compounds as pesticides CBR3, CYCS, HCN1 ABCB1 2440/4885ABCG2 1654/4885KDM4E 3487/4885
US-20240016152-A1 ACTIVE COMPOUND COMBINATIONS CYP51A1, ERG28, BROX ABCB1 411/4885ABCG2 942/4885KDM4E 978/4885
US-20230165252-A1 ACTIVE COMPOUND COMBINATIONS CYP51A1, ERG28, BROX ABCB1 411/4885ABCG2 942/4885KDM4E 978/4885
US-20240365785-A1 ACTIVE COMPOUND COMBINATIONS AND FUNGICIDE COMPOSITIONS COMPRISING THOSE DDT, TH, HPD ABCB1 1938/4885ABCG2 2067/4885KDM4E 249/4885

“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.