SCHEMBL22396281

SCHEMBL22396281

Cc1cc(Cl)cc2cc(C(=O)O)[nH]c12

nearest known ligand 0.59

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
HRH4 Q9H3N8 9/20 0.59
F7 P08709 1/20 0.51
F3 P13726 1/20 0.51
ALDH1A1 P00352 2/20 0.46
HPGD P15428 2/20 0.46
KDM4E B2RXH2 1/20 0.46
LMNA P02545 1/20 0.46
RHEB Q15382 2/20 0.44
PIN1 Q13526 1/20 0.44
GRIN1 Q05586 1/20 0.44
GPR35 Q9HC97 1/20 0.44
DAO P14920 1/20 0.42
MEN1 O00255 1/20 0.42
USP2 O75604 1/20 0.42
KMT2A Q03164 1/20 0.42
HSD17B10 Q99714 1/20 0.42

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
SCHEMBL3095919 0.82 HRH4 (0.57) HRH4ALDH1A1HPGDKDM4ELMNA
SCHEMBL3274871 0.82 HRH4 (0.56) HRH4F7F3ALDH1A1HPGD
SCHEMBL14115019 0.82 XDH (0.56) HRH4ALDH1A1KDM4EUSP2
SCHEMBL2452663 0.80 ALOX15 (0.58) HRH4ALDH1A1HPGDKDM4ELMNA
SCHEMBL28004365 0.79 HPGD (0.46) HRH4ALDH1A1HPGDKDM4ELMNA
SCHEMBL4154967 0.79 HRH4 (0.59) HRH4F7F3ALDH1A1HPGD
SCHEMBL17865579 0.79 HRH4 (0.58) HRH4F7F3ALDH1A1HPGD
SCHEMBL3031256 0.79 HPGD (0.46) HRH4ALDH1A1HPGDKDM4ELMNA
SCHEMBL2310258 0.79 KDM4E (0.51) HRH4ALDH1A1HPGDKDM4EGPR35
SCHEMBL15344006 0.76 HRH4 (0.59) HRH4F7F3ALDH1A1HPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11267825-B2 Highly active amino-thiazole substituted indole-2-carboxamides active against the hepatitis B virus (HBV) AICURIS GMBH & CO. KG (DE) 2022-03-08 US disclosed
US-20200354379-A1 NOVEL, HIGHLY ACTIVE AMINO-THIAZOLE SUBSTITUTED INDOLE-2-CARBOXAMIDES ACTIVE AGAINST THE HEPATITIS B VIRUS (HBV) AICURIS GMBH & CO. KG (DE) 2020-11-12 US disclosed
EP-3704127-A1 NOVEL, HIGHLY ACTIVE AMINO-THIAZOLE SUBSTITUTED INDOLE-2-CARBOXAMIDES ACTIVE AGAINST THE HEPATITIS B VIRUS (HBV) AiCuris GmbH & Co. KG (DE) 2020-09-09 EP disclosed
CN-111448199-A Novel highly active amino-thiazole-substituted indole-2-carboxamides having activity against Hepatitis B Virus (HBV) 艾库里斯有限及两合公司 2020-07-24 CN 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 (2 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-20200354379-A1 NOVEL, HIGHLY ACTIVE AMINO-THIAZOLE SUBSTITUTED INDOLE-2-CARBOXAMIDES ACTIVE AGAINST THE HEPATITIS B VIRUS (HBV) HCCS, CDK2, BRD4 HRH4 1649/4885F7 4752/4885F3 3297/4885
US-11267825-B2 Highly active amino-thiazole substituted indole-2-carboxamides active against the hepatitis B virus (HBV) HCCS, BRD4, IDO2 HRH4 1490/4885F7 4806/4885F3 3364/4885

“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.