SCHEMBL3726642

SCHEMBL3726642

N#Cc1c(N)cc(F)cc1F

nearest known ligand 0.46

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
TRPV4 Q9HBA0 2/20 0.46
ADORA1 P30542 7/20 0.40
ADORA2A P29274 6/20 0.40
ALDH1A1 P00352 1/20 0.39
DHODH Q02127 1/20 0.37
ADORA2B P29275 1/20 0.33
KHK P50053 1/20 0.33
KDM4E B2RXH2 1/20 0.31
MDM4 O15151 1/20 0.31
IL4 P05112 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
SCHEMBL30608676 1.00 TRPV4 (0.46) TRPV4ADORA1ADORA2AALDH1A1DHODH
SCHEMBL185766 0.83 TRPV4 (0.64) TRPV4ADORA1ADORA2AALDH1A1DHODH
SCHEMBL25739687 0.82 TRPV4 (0.46) TRPV4ADORA1ADORA2AALDH1A1ADORA2B
SCHEMBL29824357 0.80 KHK (0.36) TRPV4ADORA1ADORA2ADHODHADORA2B
SCHEMBL14825530 0.78 KHK (0.35) TRPV4ADORA1ADORA2AALDH1A1ADORA2B
SCHEMBL3298610 0.78 KDM4E (0.46) TRPV4ALDH1A1DHODHKDM4E
SCHEMBL24167421 0.78 TRPV4 (0.43) TRPV4ADORA1ADORA2AIL4
SCHEMBL21563310 0.78 TRPV4 (0.43) TRPV4ADORA1ADORA2AALDH1A1DHODH
SCHEMBL15674088 0.78 TRPV4 (0.43) TRPV4ADORA1ADORA2AKHKKDM4E
SCHEMBL25235329 0.78 TRPV4 (0.43) TRPV4ADORA1ADORA2AALDH1A1ADORA2B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12528816-B2 Substituted imidazo [1,2-b] pyridazines and [1, 2, 4] triazolo [ 4,3-b] pyridazines as camkii inhibitors CARDURION PHARMACEUTICALS, INC. (US) 2026-01-20 US disclosed
US-20240182474-A1 SUBSTITUTED IMIDAZO [1,2-b] PYRIDAZINES AND [1, 2, 4] TRIAZOLO [ 4,3-b] PYRIDAZINES AS CAMKII INHIBITORS CARDURION PHARMACEUTICALS, INC. 2024-06-06 US disclosed
US-11795172-B2 Substituted imidazo[1,2-b]pyridazines and [1,2,4]triazolo[4,3-b]pyridazines as CaMKII inhibitors CARDURION PHARMACEUTICALS, INC. (US) 2023-10-24 US disclosed
CN-116940354-A Fused heteroaryl compounds and their use as CaMKII inhibitors 卡都瑞恩医药股份有限公司 2023-10-24 CN disclosed
EP-4216948-A1 FUSED HETEROARYL COMPOUNDS AND THEIR USE AS CAMKII INHIBITORS Cardurion Pharmaceuticals, Inc. (US) 2023-08-02 EP disclosed
US-20220411422-A1 ERBB RECEPTOR INHIBITORS DIZAL JIANGSU PHARMACEUTICAL CO LTD (CN) 2022-12-29 US disclosed
US-20220098207-A1 FUSED HETEROARYL COMPOUNDS AND THEIR USE AS CAMKII INHIBITORS CARDURION PHARMACEUTICALS, INC. 2022-03-31 US disclosed
WO-2022067082-A1 FUSED HETEROARYL COMPOUNDS AND THEIR USE AS CAMKII INHIBITORS CARDURION PHARMACEUTICALS, LLC (US) 2022-03-31 WO disclosed
US-20210009587-A1 ERBB RECEPTOR INHIBITORS DIZAL JIANGSU PHARMACEUTICAL CO LTD (CN) 2021-01-14 US disclosed
US-10822334-B2 ErbB receptor inhibitors DIZAL JIANGSU PHARMACEUTICAL CO LTD (CN) 2020-11-03 US disclosed
US-20050203101-A1 Benzimidazole quinolinones and uses thereof CHIRON CORPORATION 2005-09-15 US disclosed
EP-1539754-A2 BENZIMIDAZOLE QUINOLINONES AND USES THEREOF Chiron Corporation (US) 2005-06-15 EP disclosed
WO-2005047244-A2 INHIBITION OF FGFR3 AND TREATMENT OF MULTIPLE MYELOMA CHIRON CORPORATION (US) 2005-05-26 WO disclosed
US-20040092535-A1 Benzimidazole quinolinones and uses thereof CHIRON CORPORATION 2004-05-13 US disclosed
WO-2004018419-A2 BENZIMIDAZOLE QUINOLINONES AND USES THEREOF CHIRON CORPORATION (US) 2004-03-04 WO disclosed
US-5883102-A Pharmaceutically active compounds ASTRA PHARMACEUTICALS LIMITED (GB) 1999-03-16 US disclosed
CN-1204327-A Pharmaceutically active quinazoline compounds ASTRA PHARMA PROD (GB) 1999-01-06 CN disclosed
EP-0497213-B1 Process for producing 3,5-difluoroaniline ISHIHARA SANGYO KAISHA (JP) 1995-09-27 EP disclosed
US-5399767-A Process for producing 3,5-difluoraniline ISHIHARA SANGYO KAISHA LTD. (JP) 1995-03-21 US disclosed
EP-0497213-A2 Process for producing 3,5-difluoroaniline ISHIHARA SANGYO KAISHA, LTD. (JP) 1992-08-05 EP 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 (9 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-12528816-B2 Substituted imidazo [1,2-b] pyridazines and [1, 2, 4] triazolo [ 4,3-b] pyridazines as camkii inhibitors RYR2, CACNA1C, CAMK4 TRPV4 788/4885ADORA1 1749/4885ADORA2A 2255/4885
US-20220098207-A1 FUSED HETEROARYL COMPOUNDS AND THEIR USE AS CAMKII INHIBITORS CAMK2B, CAMK2A, CAMK2G TRPV4 602/4885ADORA1 2886/4885ADORA2A 2438/4885
US-20220411422-A1 ERBB RECEPTOR INHIBITORS ERBB2, EGFR, ERBB3 TRPV4 823/4885ADORA1 2310/4885ADORA2A 1476/4885
US-20050203101-A1 Benzimidazole quinolinones and uses thereof H4C1; H4C2; H4C3; H4C4; H4C5; H4C6; H4C8; H4C9; H4C11; H4C12; H4C13; H4C14; H4C15; H4C16, TP53, PBRM1 TRPV4 1955/4885ADORA1 3395/4885ADORA2A 3095/4885
US-20210009587-A1 ERBB RECEPTOR INHIBITORS ERBB2, EGFR, ERBB3 TRPV4 823/4885ADORA1 2310/4885ADORA2A 1476/4885
US-20040092535-A1 Benzimidazole quinolinones and uses thereof GAA, ALPI, IL4I1 TRPV4 3780/4885ADORA1 2560/4885ADORA2A 4151/4885
US-10822334-B2 ErbB receptor inhibitors ERBB2, EGFR, ERBB3 TRPV4 823/4885ADORA1 2310/4885ADORA2A 1476/4885
US-20240182474-A1 SUBSTITUTED IMIDAZO [1,2-b] PYRIDAZINES AND [1, 2, 4] TRIAZOLO [ 4,3-b] PYRIDAZINES AS CAMKII INHIBITORS CAMK2B, RYR2, CAMK2A TRPV4 424/4885ADORA1 1054/4885ADORA2A 1227/4885
US-11795172-B2 Substituted imidazo[1,2-b]pyridazines and [1,2,4]triazolo[4,3-b]pyridazines as CaMKII inhibitors CAMK2B, RYR2, CAMK2A TRPV4 424/4885ADORA1 1054/4885ADORA2A 1227/4885

“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.