SCHEMBL3236165

SCHEMBL3236165

COc1c(C)cccc1Cl

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ RAB9A P51151 3/20 0.50
▸ MAPT P10636 2/20 0.50
▸ L3MBTL1 Q9Y468 2/20 0.50
▸ GAA P10253 1/20 0.50
▸ KDM4E B2RXH2 5/20 0.49
▸ NPC1 O15118 2/20 0.42
▸ PKM P14618 1/20 0.41
▸ HPGD P15428 1/20 0.41
▸ ALDH1A1 P00352 3/20 0.41
▸ HSD17B10 Q99714 1/20 0.41
▸ NOTUM Q6P988 1/20 0.41
▸ TAS1R3 Q7RTX0 1/20 0.40
▸ TAS1R1 Q7RTX1 1/20 0.40
▸ TAS1R2 Q8TE23 1/20 0.40
▸ HTR1A P08908 2/20 0.39
▸ SLC6A2 P23975 1/20 0.39
▸ MAPK1 P28482 1/20 0.39
▸ SMN1; SMN2 Q16637 1/20 0.39
▸ HSP90AA1 P07900 1/20 0.38
▸ HTR7 P34969 1/20 0.36

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
SCHEMBL254822 0.85 KDM4E (0.46) RAB9AMAPTL3MBTL1GAAKDM4E
SCHEMBL145464 0.82 ALDH1A1 (0.48) KDM4EHPGDALDH1A1HSD17B10MAPK1
SCHEMBL19897383 0.81 KDM4E (0.47) RAB9AMAPTL3MBTL1GAAKDM4E
SCHEMBL14985358 0.81 KDM4E (0.49) RAB9AMAPTL3MBTL1GAAKDM4E
SCHEMBL29048096 0.80 KDM4E (0.43) RAB9AMAPTL3MBTL1GAAKDM4E
SCHEMBL8337860 0.79 KDM4E (0.47) RAB9AMAPTL3MBTL1GAAKDM4E
SCHEMBL26281112 0.78 ALDH1A1 (0.47) RAB9AMAPTL3MBTL1GAAKDM4E
Methyl Alcohol SCHEMBL28303521 0.77 ALDH1A1 (0.46) L3MBTL1KDM4EHPGDALDH1A1HSD17B10
SCHEMBL16733990 0.76 KDM4E (0.45) RAB9AMAPTL3MBTL1GAAKDM4E
SCHEMBL197298 0.76 SMN1; SMN2 (0.50) RAB9AMAPTL3MBTL1GAAKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3891152-A1 TYROSINE KINASE INHIBITORS, COMPOSITIONS AND METHODS THERE OF Betta Pharmaceuticals Co., Ltd (CN) 2021-10-13 — — EP claimed
WO-2020114499-A1 TYROSINE KINASE INHIBITORS, COMPOSITIONS AND METHODS THERE OF BETTA PHARMACEUTICALS CO., LTD (CN) 2020-06-11 — — WO claimed
CN-106518630-B A method of the synthesis chloro- 2- methoxy toluene of 6- 江苏扬农化工股份有限公司 2019-04-19 — — CN claimed
US-5475155-A Reacting an alpha-haloketone with a phenolic-hydroxyl containing compound and a strong protonic acid; neutralization; dehydrohalogenation; dealkylation THE DOW CHEMICAL COMPANY (US) 1995-12-12 — — US claimed
WO-1995015301-A1 PREPARATION OF 4,4'-DIHYDROXY-ALPHA-ALKYLSTILBENES AND 4,4'-DIHYDROXY-ALPHA, ALPHA'-DIALKYLSTILBENES THE DOW CHEMICAL COMPANY (US) 1995-06-08 — — WO claimed
US-20230364070-A1 PYRROLO[3,2-C]PYRIDIN-4-ONE DERIVATIVES USEFUL IN THE TREATMENT OF CANCER ANTARES THERAPEUTICS, INC. 2023-11-16 — — US disclosed
US-20230346753-A1 NOVEL COMPOUNDS AND COMPOSITIONS FOR THE INHIBITION OF NAMPT VALO HEALTH, INC. 2023-11-02 — — US disclosed
EP-4048397-B1 GLUCOSYLCERAMIDE SYNTHASE INHIBITORS FOR THERAPEUTIC APPLICATIONS UNIV MICHIGAN REGENTS (US) 2023-08-16 — — EP disclosed
US-11666577-B2 MLKL inhibitors NATIONAL INSTITUTE OF BIOLOGICAL SCIENCES, BEIJING (CN) 2023-06-06 — — US disclosed
CN-110573509-B MLKL inhibitors 北京生命科学研究所 2023-05-26 — — CN disclosed
WO-2022109001-A1 GCN2 AND PERK KINASE INHIBITORS AND METHODS OF USE THEREOF DECIPHERA PHARMACEUTICALS, LLC (US) 2022-05-27 — — WO disclosed
WO-2022094271-A1 METHODS FOR TREATING CANCER SCORPION THERAPEUTICS, INC. (US) 2022-05-05 — — WO disclosed
WO-1998011043-A1 PROCESS FOR PREPARING STILBENE DIOLS THE DOW CHEMICAL COMPANY (US) 1998-03-19 — — WO disclosed
US-5723693-A Process for preparing and recovering 4,4'-dihydroxy-alpha-alkylstilbene or 4,4'-dihydroxy-alpha, alpha'dialkylstilbene THE DOW CHEMICAL COMPANY (US) 1998-03-03 — — US disclosed
US-5475155-A Reacting an alpha-haloketone with a phenolic-hydroxyl containing compound and a strong protonic acid; neutralization; dehydrohalogenation; dealkylation THE DOW CHEMICAL COMPANY (US) 1995-12-12 — — US disclosed
US-5444083-A DOPAMINE AGONIST FOR TREATING OR PREVENTION OF HYPERTENSION OR HEART FAILURE EISAI CO., LTD. (JP) 1995-08-22 — — US disclosed
WO-1995015301-A1 PREPARATION OF 4,4'-DIHYDROXY-ALPHA-ALKYLSTILBENES AND 4,4'-DIHYDROXY-ALPHA, ALPHA'-DIALKYLSTILBENES THE DOW CHEMICAL COMPANY (US) 1995-06-08 — — WO disclosed
US-5414150-A Preparation of 4,4'-dihydroxy-alpha-alkylstilbenes and 4,4'-dihydroxy-alpha, alpha'-dialkylstilbenes THE DOW CHEMICAL COMPANY (US) 1995-05-09 — — US disclosed
EP-0381235-B1 PYRROLIDINE COMPOUND AND PHARMACEUTICAL USE Eisai Co., Ltd. (JP) 1993-07-28 — — EP disclosed
EP-0381235-A2 Pyrrolidine compound and pharmaceutical use Eisai Co., Ltd. (JP) 1990-08-08 — — 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 (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-20230364070-A1 PYRROLO[3,2-C]PYRIDIN-4-ONE DERIVATIVES USEFUL IN THE TREATMENT OF CANCER ERBB2, EGFR, ERBB3 RAB9A 3718/4885MAPT 1075/4885L3MBTL1 4678/4885
US-11666577-B2 MLKL inhibitors MLKL, CMKLR1, PCSK9 RAB9A 2346/4885MAPT 1245/4885L3MBTL1 1031/4885
US-20230346753-A1 NOVEL COMPOUNDS AND COMPOSITIONS FOR THE INHIBITION OF NAMPT NAMPT, NNMT, NQO1 RAB9A 1445/4885MAPT 519/4885L3MBTL1 3563/4885

“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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