SCHEMBL20143007

SCHEMBL20143007

O=C(N[C@H]1CCOc2ccccc21)c1cnc2c(-c3cccc(Cl)c3Cl)cccc2c1N1CCOCC1

nearest known ligand 0.39

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ CNR2 P34972 7/20 0.39
▸ CNR1 P21554 1/20 0.39
▸ TRPV1 Q8NER1 2/20 0.39
▸ PKM P14618 1/20 0.38
▸ P2RX7 Q99572 3/20 0.38
▸ TP53 P04637 2/20 0.38
▸ USP2 O75604 1/20 0.38
▸ MAPK1 P28482 1/20 0.38
▸ RECQL P46063 1/20 0.38
▸ HSD17B10 Q99714 1/20 0.38
▸ RAB9A P51151 1/20 0.38
▸ THRB P10828 1/20 0.37
▸ BRD4 O60885 2/20 0.37
▸ CREBBP Q92793 2/20 0.37
▸ PAK1 Q13153 1/20 0.37

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
SCHEMBL30071194 1.00 CNR2 (0.39) CNR2CNR1TRPV1PKMP2RX7
SCHEMBL20154267 1.00 CNR2 (0.39) CNR2CNR1TRPV1PKMP2RX7
SCHEMBL29438254 0.93 CNR2 (0.38) CNR2CNR1TRPV1PKMP2RX7
SCHEMBL20600383 0.93 CNR2 (0.38) CNR2CNR1TRPV1PKMP2RX7
SCHEMBL21875798 0.91 P2RX7 (0.38) CNR2CNR1TRPV1PKMP2RX7
SCHEMBL20621805 0.91 P2RX7 (0.38) CNR2CNR1TRPV1PKMP2RX7
SCHEMBL29438262 0.91 P2RX7 (0.38) CNR2CNR1TRPV1PKMP2RX7
SCHEMBL20600069 0.91 P2RX7 (0.39) CNR2CNR1TRPV1P2RX7MAPK1
SCHEMBL29438334 0.91 P2RX7 (0.39) CNR2CNR1TRPV1P2RX7MAPK1
SCHEMBL23505822 0.90 PKM (0.39) CNR2CNR1TRPV1PKMP2RX7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11505545-B2 Anthelmintic quinoline-3-carboxamide derivatives BAYER ANIMAL HEALTH GMBH (DE) 2022-11-22 — — US disclosed
CN-109890793-B Novel anthelmintic quinoline-3-carboxamide derivatives 拜耳动物保健有限责任公司 2022-11-18 — — CN disclosed
EP-3538512-B1 NEW ANTHELMINTIC QUINOLINE-3-CARBOXAMIDE DERIVATIVES BAYER ANIMAL HEALTH GMBH (DE) 2021-06-16 — — EP disclosed
EP-3538512-B1 NEW ANTHELMINTIC QUINOLINE-3-CARBOXAMIDE DERIVATIVES BAYER ANIMAL HEALTH GMBH (DE) 2021-06-16 — — EP disclosed
US-20210115026-A1 NEW ANTHELMINTIC QUINOLINE-3-CARBOXAMIDE DERIVATIVES ELANCO ANIMAL HEALTH GMBH (DE) 2021-04-22 — — US disclosed
US-20210115026-A1 NEW ANTHELMINTIC QUINOLINE-3-CARBOXAMIDE DERIVATIVES ELANCO ANIMAL HEALTH GMBH (DE) 2021-04-22 — — US disclosed
US-10889573-B2 Anthelmintic quinoline-3-carboxamide derivatives BAYER ANIMAL HEALTH GMBH (DE) 2021-01-12 — — US disclosed
US-10889573-B2 Anthelmintic quinoline-3-carboxamide derivatives BAYER ANIMAL HEALTH GMBH (DE) 2021-01-12 — — US disclosed
EP-3538512-A1 NEW ANTHELMINTIC QUINOLINE-3-CARBOXAMIDE DERIVATIVES Bayer Animal Health GmbH (DE) 2019-09-18 — — EP disclosed
WO-2018087036-A1 NEW ANTHELMINTIC QUINOLINE-3-CARBOXAMIDE DERIVATIVES BAYER ANIMAL HEALTH GMBH (DE) 2018-05-17 — — WO disclosed
WO-2018087036-A1 NEW ANTHELMINTIC QUINOLINE-3-CARBOXAMIDE DERIVATIVES BAYER ANIMAL HEALTH GMBH (DE) 2018-05-17 — — 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 (3 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-11505545-B2 Anthelmintic quinoline-3-carboxamide derivatives HRH4, HRH2, H1-5 CNR2 80/4885CNR1 88/4885TRPV1 695/4885
US-20210115026-A1 NEW ANTHELMINTIC QUINOLINE-3-CARBOXAMIDE DERIVATIVES HRH4, HRH2, HRH1 CNR2 64/4885CNR1 77/4885TRPV1 683/4885
US-10889573-B2 Anthelmintic quinoline-3-carboxamide derivatives HRH4, HRH2, H1-5 CNR2 75/4885CNR1 92/4885TRPV1 739/4885

“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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