SCHEMBL3100612

SCHEMBL3100612

Cc1c(F)ccc2[nH]c(C(=O)O)cc12

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HRH4 Q9H3N8 1/20 0.60
EIF4A3 P38919 2/20 0.53
KDM4E B2RXH2 4/20 0.51
ALDH1A1 P00352 4/20 0.51
HSD17B10 Q99714 3/20 0.51
LMNA P02545 2/20 0.51
HPGD P15428 3/20 0.50
CYP2C19 P33261 2/20 0.50
PIN1 Q13526 1/20 0.50
PDPK1 O15530 1/20 0.50
TSHR P16473 1/20 0.50
NFKB1 P19838 1/20 0.50
APEX1 P27695 1/20 0.50
TDP1 Q9NUW8 1/20 0.50
IDO1 P14902 4/20 0.49
TDO2 P48775 4/20 0.49
THRB P10828 1/20 0.49
RHEB Q15382 2/20 0.47
NGFR P08138 1/20 0.46
GRIN1 Q05586 2/20 0.46

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
SCHEMBL29974441 0.83 KDM4E (0.54) EIF4A3KDM4EALDH1A1HSD17B10LMNA
SCHEMBL3107966 0.83 ALDH1A1 (0.54) EIF4A3KDM4EALDH1A1HSD17B10LMNA
SCHEMBL10085352 0.83 KDM4E (0.54) EIF4A3KDM4EALDH1A1HSD17B10LMNA
SCHEMBL5622542 0.80 KDM4E (0.56) HRH4KDM4EALDH1A1HSD17B10LMNA
SCHEMBL29425136 0.80 DAO (0.58) EIF4A3KDM4EALDH1A1HSD17B10LMNA
SCHEMBL3096730 0.80 GRIN1 (0.54) HRH4EIF4A3KDM4EALDH1A1HSD17B10
SCHEMBL27896910 0.80 NGFR (0.54) EIF4A3KDM4EALDH1A1HSD17B10LMNA
SCHEMBL20504988 0.80 EIF4A3 (0.56) EIF4A3KDM4EALDH1A1HSD17B10LMNA
SCHEMBL22620683 0.80 KDM4E (0.51) EIF4A3KDM4EALDH1A1HSD17B10LMNA
SCHEMBL6161388 0.80 DAO (0.58) EIF4A3KDM4EALDH1A1HSD17B10LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3976617-B1 FUSED HETEROCYCLIC DERIVATIVES JANSSEN SCIENCES IRELAND UNLIMITED CO (IE) 2025-04-23 EP disclosed
US-20240228504-A1 SUBSTITUTED TRICYCLIC AMIDES, ANALOGUES THEREOF, AND METHODS USING SAME ARBUTUS BIOPHARMA CORPORATION (CA) 2024-07-11 US disclosed
EP-3962909-B1 NOVEL OXALYL PIPERAZINES ACTIVE AGAINST THE HEPATITIS B VIRUS (HBV) AICURIS GMBH & CO KG (DE) 2023-10-04 EP disclosed
US-20220363686-A1 NOVEL 6,7-DIHYDRO-4H-PYRAZOLO[1,5-A]PYRAZINE INDOLE-2-CARBOXAMIDES ACTIVE AGAINST THE HEPATITIS B VIRUS (HBV) AICURIS GMBH & CO. KG (DE) 2022-11-17 US disclosed
US-20220348592-A1 FUSED HETEROCYCLIC DERIVATIVES JANSSEN PHARMACEUTICA NV (BE) 2022-11-03 US disclosed
US-20220306647-A1 NOVEL INDOLE-2-CARBOXAMIDES ACTIVE AGAINST THE HEPATITUS B VIRUS (HBV) AICURIS GMBH & CO. KG (DE) 2022-09-29 US disclosed
US-20220227737-A1 NOVEL OXALYL PIPERAZINES ACTIVE AGAINST THE HEPATITIS B VIRUS (HBV) AICURIS GMBH & CO. KG (DE) 2022-07-21 US disclosed
EP-3962909-A1 NOVEL OXALYL PIPERAZINES ACTIVE AGAINST THE HEPATITIS B VIRUS (HBV) AiCuris GmbH & Co. KG (DE) 2022-03-09 EP disclosed
CN-113767101-A Novel indole-2-carboxamides having anti-Hepatitis B Virus (HBV) activity 艾库里斯有限及两合公司 2021-12-07 CN disclosed
CN-113748111-A Novel oxalyl piperazine compounds with anti-Hepatitis B Virus (HBV) activity 艾库里斯有限及两合公司 2021-12-03 CN disclosed
US-7799923-B2 Vasopressin receptor antagonists; (4-Benzotriazol-1-yl-piperidin-1-yl)-(5-chloro-1H-indol-2-yl)-methanone; antidepressants, anxiolytic agents; dysmenorrhea, hypertension, inappropriate secretion of vasopressin, liver cirrhosis, nephrotic syndrome, obsessive compulsive disorder HOFFMANN-LA ROCHE INC. (US) 2010-09-21 US disclosed
EP-2089381-B1 INDOLES WHICH ACT AS VIA RECEPTOR ANTAGONISTS HOFFMANN LA ROCHE (CH) 2010-06-30 EP disclosed
CN-101541786-A Indoles as V1a receptor antagonists HOFFMANN LA ROCHE (CH) 2009-09-23 CN disclosed
EP-2089381-A1 INDOLES WHICH ACT AS VIA RECEPTOR ANTAGONISTS F.HOFFMANN-LA ROCHE AG (CH) 2009-08-19 EP disclosed
US-20080269290-A1 Indoles F. HOFFMANN-LA ROCHE AG (CH) 2008-10-30 US disclosed
US-20080139618-A1 INDOLES HOFFMAN-LA ROCHE INC. 2008-06-12 US disclosed
WO-2008068184-A1 INDOLES WHICH ACT AS VIA RECEPTOR ANTAGONISTS F. HOFFMANN-LA ROCHE AG (CH) 2008-06-12 WO disclosed
US-20080139548-A1 INDOLES F. HOFFMANN-LA ROCHE AG (CH) 2008-06-12 US disclosed
US-20080139617-A1 INDOLES HOFFMAN-LA ROCHE INC. 2008-06-12 US disclosed
US-4060626-A Indole-carboxylic carbon compounds and pharmaceutical compositions containing them BOEHRINGER MANNHEIM G.M.B.H. (DT) 1977-11-29 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 (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-20220227737-A1 NOVEL OXALYL PIPERAZINES ACTIVE AGAINST THE HEPATITIS B VIRUS (HBV) HCCS, ZC3HAV1, MAVS HRH4 3609/4885EIF4A3 664/4885KDM4E 1671/4885
US-20080139548-A1 INDOLES HTR1A, AVPR1A, TPH1 HRH4 220/4885EIF4A3 1731/4885KDM4E 1393/4885
US-20080139617-A1 INDOLES HTR1A, AVPR1A, TPH1 HRH4 220/4885EIF4A3 1731/4885KDM4E 1393/4885
US-20240228504-A1 SUBSTITUTED TRICYCLIC AMIDES, ANALOGUES THEREOF, AND METHODS USING SAME SLC10A1, NR1H4, SLC10A2 HRH4 1562/4885EIF4A3 1474/4885KDM4E 1496/4885
US-20220363686-A1 NOVEL 6,7-DIHYDRO-4H-PYRAZOLO[1,5-A]PYRAZINE INDOLE-2-CARBOXAMIDES ACTIVE AGAINST THE HEPATITIS B VIRUS (HBV) HCCS, CDK2, BRD4 HRH4 1200/4885EIF4A3 442/4885KDM4E 569/4885
US-20080269290-A1 Indoles HTR1A, AVPR1A, TPH1 HRH4 220/4885EIF4A3 1731/4885KDM4E 1393/4885
US-20220348592-A1 FUSED HETEROCYCLIC DERIVATIVES HAVCR2, HCCS, GOT2 HRH4 888/4885EIF4A3 968/4885KDM4E 3515/4885
US-20220306647-A1 NOVEL INDOLE-2-CARBOXAMIDES ACTIVE AGAINST THE HEPATITUS B VIRUS (HBV) HCCS, IDO1, BRD4 HRH4 1969/4885EIF4A3 865/4885KDM4E 1019/4885
US-20080139618-A1 INDOLES HTR1A, AVPR1A, TPH1 HRH4 220/4885EIF4A3 1731/4885KDM4E 1393/4885

“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.