SCHEMBL3735675

SCHEMBL3735675

COc1cc([N+](=O)[O-])c(Br)nc1OC

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 5/20 0.46
▸ KDM4E B2RXH2 1/20 0.46
▸ CYP3A4 P08684 1/20 0.46
▸ MAPT P10636 1/20 0.46
▸ ALOX15 P16050 1/20 0.46
▸ PRKDC P78527 1/20 0.46
▸ HSD17B10 Q99714 1/20 0.46
▸ TDP1 Q9NUW8 2/20 0.43
▸ PIN1 Q13526 1/20 0.40
▸ L3MBTL1 Q9Y468 3/20 0.39
▸ LMNA P02545 2/20 0.39
▸ CASP3 P42574 1/20 0.39
▸ SENP8 Q96LD8 1/20 0.39
▸ SENP7 Q9BQF6 1/20 0.39
▸ SENP6 Q9GZR1 1/20 0.39
▸ PDGFRB P09619 1/20 0.38
▸ PDGFRA P16234 1/20 0.38
▸ HTT P42858 1/20 0.38
▸ CYP2D6 P10635 1/20 0.38
▸ ABCB1 P08183 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
SCHEMBL30423969 1.00 ALDH1A1 (0.46) ALDH1A1KDM4ECYP3A4MAPTALOX15
SCHEMBL2144114 0.86 ALDH1A1 (0.49) ALDH1A1KDM4ECYP3A4MAPTALOX15
SCHEMBL30423974 0.86 ALDH1A1 (0.49) ALDH1A1KDM4ECYP3A4MAPTALOX15
SCHEMBL19814093 0.82 MERTK (0.41) ALDH1A1KDM4ECYP3A4MAPTALOX15
SCHEMBL3290603 0.81 ALDH1A1 (0.47) ALDH1A1KDM4ECYP3A4MAPTALOX15
SCHEMBL21198864 0.78 MAPT (0.44) ALDH1A1KDM4ECYP3A4MAPTALOX15
SCHEMBL20303884 0.76 ALDH1A1 (0.50) ALDH1A1KDM4ETDP1LMNACYP2D6
SCHEMBL21617731 0.76 PIN1 (0.40) ALDH1A1KDM4ECYP3A4MAPTHSD17B10
SCHEMBL24251661 0.75 ALDH1A1 (0.46) ALDH1A1MAPTL3MBTL1LMNAHTT
SCHEMBL29756268 0.75 ALDH1A1 (0.46) ALDH1A1MAPTL3MBTL1LMNAHTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3743068-B1 COMPOUNDS FOR THE TREATMENT OF KINASE-DEPENDENT DISORDERS EXELIXIS INC (US) 2026-04-29 — — EP disclosed
US-12195475-B2 Compounds for the treatment of kinase-dependent disorders EXELIXIS, INC. (US) 2025-01-14 — — US disclosed
CN-111936487-B Compounds for the treatment of kinase dependent disorders 埃克塞里艾克西斯公司 2024-07-09 — — CN disclosed
CN-112312909-B Compounds for the treatment of kinase dependent disorders 埃克塞里艾克西斯公司 2024-07-02 — — CN disclosed
US-20240150371-A1 Compounds for the Treatment of Kinase-Dependent Disorders EXELIXIS, INC. 2024-05-09 — — US disclosed
US-20230374024-A1 Compounds for the Treatment of Kinase-Dependent Disorders EXELIXIS, INC. 2023-11-23 — — US disclosed
US-11708367-B2 Compounds for the treatment of kinase-dependent disorders EXELIXIS, INC. (US) 2023-07-25 — — US disclosed
US-11673897-B2 Compounds for the treatment of kinase-dependent disorders EXELIXIS, INC. (US) 2023-06-13 — — US disclosed
CN-116143763-A GAS41 targeting compound, GAS41 inhibitor and pharmaceutical composition and application thereof 清华大学 2023-05-23 — — CN disclosed
US-20210040099-A1 Compounds for the Treatment of Kinase-Dependent Disorders EXELIXIS, INC. 2021-02-11 — — US disclosed
CN-112312909-A Compounds for the treatment of kinase-dependent disorders 埃克塞里艾克西斯公司 2021-02-02 — — CN disclosed
EP-3743417-A1 COMPOUNDS FOR THE TREATMENT OF KINASE-DEPENDENT DISORDERS Exelixis, Inc. (US) 2020-12-02 — — EP disclosed
EP-3743068-A1 COMPOUNDS FOR THE TREATMENT OF KINASE-DEPENDENT DISORDERS Exelixis, Inc. (US) 2020-12-02 — — EP disclosed
CN-111936487-A Compounds for the treatment of kinase-dependent disorders 埃克塞里艾克西斯公司 2020-11-13 — — CN disclosed
WO-2019148043-A1 COMPOUNDS FOR THE TREATMENT OF KINASE-DEPENDENT DISORDERS EXELIXIS, INC. (US) 2019-08-01 — — WO disclosed
WO-2019148036-A1 COMPOUNDS FOR THE TREATMENT OF KINASE-DEPENDENT DISORDERS EXELIXIS, INC. (US) 2019-08-01 — — WO disclosed
US-8273890-B2 Thiophene-imidazopyridines 4SC AG (DE) 2012-09-25 — — US disclosed
US-20100278833-A1 THIOPHENE-IMIDAZOPYRIDINES 4SC AG (DE) 2010-11-04 — — US disclosed
EP-2017277-A1 Thiophene-imidazopyridines 4SC AG (DE) 2009-01-21 — — EP disclosed
WO-2009003911-A1 THIOPHENE-IMIDAZOPYRIDINES 4SC AG (DE) 2009-01-08 — — 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 (7 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-11708367-B2 Compounds for the treatment of kinase-dependent disorders ERBB2, ERBB3, MAP3K6 ALDH1A1 3215/4885KDM4E 2929/4885CYP3A4 4677/4885
US-20210040099-A1 Compounds for the Treatment of Kinase-Dependent Disorders ERBB2, ERBB3, MAP3K6 ALDH1A1 3215/4885KDM4E 2929/4885CYP3A4 4677/4885
US-20230374024-A1 Compounds for the Treatment of Kinase-Dependent Disorders ERBB2, ERBB3, MAP3K6 ALDH1A1 3215/4885KDM4E 2929/4885CYP3A4 4677/4885
US-20100278833-A1 THIOPHENE-IMIDAZOPYRIDINES PIKFYVE, PIP4K2B, PIP5K1B ALDH1A1 3695/4885KDM4E 1387/4885CYP3A4 1450/4885
US-20240150371-A1 Compounds for the Treatment of Kinase-Dependent Disorders ERBB2, MAP3K6, PRKCH ALDH1A1 3263/4885KDM4E 2792/4885CYP3A4 4686/4885
US-12195475-B2 Compounds for the treatment of kinase-dependent disorders ERBB2, ERBB3, MAP3K6 ALDH1A1 3215/4885KDM4E 2929/4885CYP3A4 4677/4885
US-11673897-B2 Compounds for the treatment of kinase-dependent disorders ERBB2, MAP3K6, PRKCH ALDH1A1 3263/4885KDM4E 2792/4885CYP3A4 4686/4885

“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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