SCHEMBL6489433

SCHEMBL6489433

OCc1ccc(F)c(F)c1Br

nearest known ligand 0.35

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
GPR84 Q9NQS5 1/20 0.35
CES2 O00748 1/20 0.33
CES1 P23141 1/20 0.33
MEP1A Q16819 1/20 0.32
MEP1B Q16820 1/20 0.32
RIPK1 Q13546 1/20 0.31

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
SCHEMBL27771994 0.85 APOBEC3G (0.31)
SCHEMBL31167597 0.84 MEP1A (0.31) GPR84MEP1AMEP1B
SCHEMBL31719921 0.80 PDCD1 (0.33)
SCHEMBL698604 0.80 CES2 (0.41) GPR84CES2CES1RIPK1
SCHEMBL29780412 0.80 CES2 (0.41) GPR84CES2CES1RIPK1
SCHEMBL31615014 0.77 DRD4 (0.33)
SCHEMBL17295763 0.77 MEP1B (0.35) MEP1AMEP1B
SCHEMBL21857947 0.77
SCHEMBL3310848 0.76 CES2 (0.38) GPR84CES2CES1RIPK1
SCHEMBL20607946 0.76 CES2 (0.33) GPR84CES2CES1RIPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118556063-A Heterocyclic compound, pharmaceutical composition and application thereof 上海湃隆生物科技有限公司 2024-08-27 CN disclosed
CN-115232144-B Nitrogen-containing condensed ring derivative, pharmaceutical composition, and preparation method and application thereof 长春金赛药业有限责任公司 2024-04-02 CN disclosed
WO-2023138583-A1 HETEROCYCLIC COMPOUND, PHARMACEUTICAL COMPOSITION AND USE THEREOF 上海湃隆生物科技有限公司 2023-07-27 WO disclosed
CN-115232144-A Nitrogen-containing fused ring derivative, pharmaceutical composition, preparation method and application thereof 长春金赛药业有限责任公司 2022-10-25 CN disclosed
WO-2021254417-A1 BICYCLIC COMPOUND AND APPLICATION THEREOF 贝达药业股份有限公司 2021-12-23 WO disclosed
WO-2021254416-A1 INDANONE COMPOUND AND USE THEREOF 贝达药业股份有限公司 2021-12-23 WO disclosed
EP-2892893-B2 6-AMINO ACID HETEROARYLDIHYDROPYRIMIDINES FOR THE TREATMENT AND PROPHYLAXIS OF HEPATITIS B VIRUS INFECTION HOFFMANN LA ROCHE (CH) 2019-10-16 EP disclosed
EP-2892893-B2 6-AMINO ACID HETEROARYLDIHYDROPYRIMIDINES FOR THE TREATMENT AND PROPHYLAXIS OF HEPATITIS B VIRUS INFECTION HOFFMANN LA ROCHE (CH) 2019-10-16 EP disclosed
WO-2018030550-A1 HETEROCYCLIC COMPOUNDS WITH AN ROR(GAMMA)T MODULATING ACTIVITY TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2018-02-15 WO disclosed
EP-2892893-B1 6-AMINO ACID HETEROARYLDIHYDROPYRIMIDINES FOR THE TREATMENT AND PROPHYLAXIS OF HEPATITIS B VIRUS INFECTION HOFFMANN LA ROCHE (CH) 2016-12-21 EP disclosed
US-20160237078-A9 NOVEL 6-AMINO ACID HETEROARYLDIHYDROPYRIMIDINES FOR THE TREATMENT AND PROPHYLAXIS OF HEPATITIS B VIRUS INFECTION HOFFMANN-LA ROCHE INC. (US) 2016-08-18 US disclosed
US-20160237078-A9 NOVEL 6-AMINO ACID HETEROARYLDIHYDROPYRIMIDINES FOR THE TREATMENT AND PROPHYLAXIS OF HEPATITIS B VIRUS INFECTION HOFFMANN-LA ROCHE INC. (US) 2016-08-18 US disclosed
US-20160237078-A9 NOVEL 6-AMINO ACID HETEROARYLDIHYDROPYRIMIDINES FOR THE TREATMENT AND PROPHYLAXIS OF HEPATITIS B VIRUS INFECTION HOFFMANN-LA ROCHE INC. (US) 2016-08-18 US disclosed
EP-2892893-A1 6-AMINO ACID HETEROARYLDIHYDROPYRIMIDINES FOR THE TREATMENT AND PROPHYLAXIS OF HEPATITIS B VIRUS INFECTION F.HOFFMANN-LA ROCHE AG (CH) 2015-07-15 EP disclosed
US-20150031687-A1 Novel 6-amino acid heteroaryldihydropyrimidines for the treatment and prophylaxis of hepatitis B virus infection HOFFMANN-LA ROCHE INC. (US) 2015-01-29 US disclosed
US-20150031687-A1 Novel 6-amino acid heteroaryldihydropyrimidines for the treatment and prophylaxis of hepatitis B virus infection HOFFMANN-LA ROCHE INC. (US) 2015-01-29 US disclosed
US-20150031687-A1 Novel 6-amino acid heteroaryldihydropyrimidines for the treatment and prophylaxis of hepatitis B virus infection HOFFMANN-LA ROCHE INC. (US) 2015-01-29 US disclosed
WO-2014037480-A1 6-AMINO ACID HETEROARYLDIHYDROPYRIMIDINES FOR THE TREATMENT AND PROPHYLAXIS OF HEPATITIS B VIRUS INFECTION F. HOFFMANN-LA ROCHE AG (CH) 2014-03-13 WO disclosed
WO-2014037480-A1 6-AMINO ACID HETEROARYLDIHYDROPYRIMIDINES FOR THE TREATMENT AND PROPHYLAXIS OF HEPATITIS B VIRUS INFECTION F. HOFFMANN-LA ROCHE AG (CH) 2014-03-13 WO disclosed
US-20050256177-A1 Phenyl derivatives for the treatment of abnormal cell growth PFIZER INC 2005-11-17 US 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-20160237078-A9 NOVEL 6-AMINO ACID HETEROARYLDIHYDROPYRIMIDINES FOR THE TREATMENT AND PROPHYLAXIS OF HEPATITIS B VIRUS INFECTION CYP2B6, HAVCR2, CYP2D6 GPR84 1007/4885CES2 1990/4885CES1 260/4885
US-20150031687-A1 Novel 6-amino acid heteroaryldihydropyrimidines for the treatment and prophylaxis of hepatitis B virus infection CYP2B6, HAVCR2, CYP2D6 GPR84 1007/4885CES2 1990/4885CES1 260/4885
US-20050256177-A1 Phenyl derivatives for the treatment of abnormal cell growth CCND3, CDC25C, CCNA1 GPR84 4028/4885CES2 1621/4885CES1 277/4885

“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.