SCHEMBL21273811

SCHEMBL21273811

O=C(NC1CCC1c1ccc(Cl)cc1Cl)c1cccnc1C(F)(F)F

nearest known ligand 0.42

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ ACKR3 P25106 3/20 0.42
▸ P2RX7 Q99572 6/20 0.41
▸ HCRTR1 O43613 8/20 0.41
▸ HDAC6 Q9UBN7 1/20 0.39
▸ CNR2 P34972 1/20 0.39

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
SCHEMBL29687045 1.00 ACKR3 (0.42) ACKR3P2RX7HCRTR1HDAC6CNR2
SCHEMBL21273819 1.00 ACKR3 (0.42) ACKR3P2RX7HCRTR1HDAC6CNR2
SCHEMBL29367888 1.00 ACKR3 (0.42) ACKR3P2RX7HCRTR1HDAC6CNR2
SCHEMBL16372435 1.00 ACKR3 (0.42) ACKR3P2RX7HCRTR1HDAC6CNR2
SCHEMBL30704818 1.00 ACKR3 (0.42) ACKR3P2RX7HCRTR1HDAC6CNR2
SCHEMBL24543387 1.00 ACKR3 (0.42) ACKR3P2RX7HCRTR1HDAC6CNR2
SCHEMBL19771728 1.00 ACKR3 (0.42) ACKR3P2RX7HCRTR1HDAC6CNR2
Water SCHEMBL22686581 0.99 ACKR3 (0.42) ACKR3P2RX7HCRTR1HDAC6CNR2
Water SCHEMBL30477660 0.99 ACKR3 (0.42) ACKR3P2RX7HCRTR1HDAC6CNR2
Water SCHEMBL28425272 0.99 ACKR3 (0.42) ACKR3P2RX7HCRTR1HDAC6CNR2

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 185 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
EP-4480542-A2 NOVEL CRYSTALLINE FORMS Syngenta Crop Protection AG (CH) 2024-12-25 — — EP claimed
US-20240365785-A1 ACTIVE COMPOUND COMBINATIONS AND FUNGICIDE COMPOSITIONS COMPRISING THOSE BAYER AKTIENGESELLSCHAFT (DE) 2024-11-07 — — US claimed
EP-4255189-B1 MIXTURES CONTAINING METARYLPICOXAMID BASF SE (DE) 2024-10-30 — — EP claimed
CN-118140927-A Sterilization insecticidal composition containing quinolone compounds and application thereof 潍坊中农联合化工有限公司 2024-06-07 — — CN claimed
US-20240023551-A1 USE OF DHODH INHIBITOR FOR CONTROLLING RESISTANT PHYTOPATHOGENIC FUNGI IN CROPS BAYER AKTIENGESELLSCHAFT (DE) 2024-01-25 — — US claimed
US-20240016152-A1 ACTIVE COMPOUND COMBINATIONS BAYER AKTIENGESELLSCHAFT (DE) 2024-01-18 — — US claimed
US-20240016150-A1 MIXTURES CONTAINING METARYLPICOXAMID BASF SE (DE) 2024-01-18 — — US claimed
EP-4255189-A1 MIXTURES CONTAINING METARYLPICOXAMID BASF SE (DE) 2023-10-11 — — EP claimed
US-20230200391-A1 ACTIVE COMPOUND COMBINATIONS AND FUNGICIDE COMPOSITIONS COMPRISING THOSE BAYER AKTIENGESELLSCHAFT (DE) 2023-06-29 — — US claimed
EP-4135518-A1 ACTIVE COMPOUND COMBINATIONS AND FUNGICIDE COMPOSITIONS COMPRISING THOSE Bayer Aktiengesellschaft (DE) 2023-02-22 — — EP claimed
WO-2022117373-A1 MIXTURES CONTAINING METARYLPICOXAMID BASF SE (DE) 2022-06-09 — — WO 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-2021209365-A1 ACTIVE COMPOUND COMBINATIONS AND FUNGICIDE COMPOSITIONS COMPRISING THOSE BAYER AKTIENGESELLSCHAFT (DE) 2021-10-21 — — WO claimed
US-11053201-B2 Crystalline forms SYNGENTA PARTICIPATIONS AG (CH) 2021-07-06 — — US claimed
EP-3752489-A1 NOVEL CRYSTALLINE FORMS SYNGENTA PARTICIPATIONS AG (CH) 2020-12-23 — — EP claimed
US-20200369614-A1 CRYSTALLINE FORMS SYNGENTA PARTICIPATIONS AG (CH) 2020-11-26 — — US claimed
CN-111741945-A Novel crystalline forms 先正达参股股份有限公司 2020-10-02 — — CN claimed
WO-2019158476-A1 NOVEL CRYSTALLINE FORMS SYNGENTA PARTICIPATIONS AG (CH) 2019-08-22 — — WO claimed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (7 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-11053201-B2 Crystalline forms TUBA3C, TUBA1C, TUBB3 ACKR3 4021/4885P2RX7 1121/4885HCRTR1 446/4885
US-20240016152-A1 ACTIVE COMPOUND COMBINATIONS CYP51A1, ERG28, BROX ACKR3 4797/4885P2RX7 1268/4885HCRTR1 3500/4885
US-20240023551-A1 USE OF DHODH INHIBITOR FOR CONTROLLING RESISTANT PHYTOPATHOGENIC FUNGI IN CROPS DHODH, SDHA, SDHB ACKR3 4868/4885P2RX7 4147/4885HCRTR1 2046/4885
US-20200369614-A1 CRYSTALLINE FORMS TUBA3C, TUBA1C, TUBB3 ACKR3 4021/4885P2RX7 1121/4885HCRTR1 446/4885
US-20230200391-A1 ACTIVE COMPOUND COMBINATIONS AND FUNGICIDE COMPOSITIONS COMPRISING THOSE ERG28, CYP51A1, ME3 ACKR3 4829/4885P2RX7 1351/4885HCRTR1 3571/4885
US-20240365785-A1 ACTIVE COMPOUND COMBINATIONS AND FUNGICIDE COMPOSITIONS COMPRISING THOSE DDT, TH, HPD ACKR3 4807/4885P2RX7 313/4885HCRTR1 3535/4885
US-20240016150-A1 MIXTURES CONTAINING METARYLPICOXAMID MTX1, MTX2, METAP1 ACKR3 4364/4885P2RX7 48/4885HCRTR1 1259/4885

“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.

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