SCHEMBL2288703

SCHEMBL2288703

Cc1ccc(C(C)(C)C)cc1N

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 6/20 0.59
▸ MAPT P10636 4/20 0.59
▸ MEN1 O00255 1/20 0.59
▸ GAA P10253 1/20 0.59
▸ PKM P14618 1/20 0.59
▸ RECQL P46063 1/20 0.59
▸ KMT2A Q03164 1/20 0.59
▸ TDP1 Q9NUW8 4/20 0.52
▸ CASP1 P29466 1/20 0.52
▸ POLB P06746 1/20 0.50
▸ CYP3A4 P08684 4/20 0.48
▸ TSHR P16473 3/20 0.44
▸ HPGD P15428 3/20 0.43
▸ ALOX15 P16050 1/20 0.43
▸ HSD17B10 Q99714 1/20 0.43
▸ MAPK1 P28482 2/20 0.40
▸ NPC1 O15118 2/20 0.39
▸ RAB9A P51151 2/20 0.39
▸ HTR1D P28221 1/20 0.39
▸ KDM4E B2RXH2 1/20 0.38

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
SCHEMBL3937305 0.86 ALDH1A1 (0.52) ALDH1A1MAPTMEN1GAAPKM
SCHEMBL29437036 0.86 ALDH1A1 (0.52) ALDH1A1MAPTMEN1GAAPKM
SCHEMBL6780538 0.83 ALDH1A1 (0.56) ALDH1A1MAPTMEN1GAAPKM
SCHEMBL23040384 0.83 KIF11 (0.45) ALDH1A1MAPTMEN1GAAPKM
SCHEMBL18899967 0.82 ALDH1A1 (0.48) ALDH1A1MAPTMEN1GAAPKM
SCHEMBL24683906 0.80 ESR1 (0.47) ALDH1A1MAPTMEN1GAAPKM
SCHEMBL256203 0.80 ALDH1A1 (0.64) ALDH1A1MAPTMEN1GAAPKM
SCHEMBL29377581 0.80 ALDH1A1 (0.64) ALDH1A1MAPTMEN1GAAPKM
SCHEMBL2009857 0.79 TSHR (0.52) ALDH1A1MAPTMEN1GAAPKM
SCHEMBL29498849 0.79 TSHR (0.52) ALDH1A1MAPTMEN1GAAPKM

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-120058785-A Metal complex, preparation method thereof and olefin polymerization method 万华化学集团股份有限公司 2025-05-30 — — CN claimed
EP-3792241-B1 METHOD FOR CONVERTING HYDROXYL GROUP OF ALCOHOL TAKASAGO PERFUMERY CO LTD (JP) 2026-04-22 — — EP disclosed
CN-120058785-A Metal complex, preparation method thereof and olefin polymerization method 万华化学集团股份有限公司 2025-05-30 — — CN disclosed
US-20230063462-A1 SULFONIMIDAMIDE COMPOUNDS AND COMPOSITIONS FOR TREATING CONDITIONS ASSOCIATED WITH NLRP ACTIVITY NOVARTIS AG (CH) 2023-03-02 — — US disclosed
US-20230047816-A1 PFKFB3 INHIBITORS AND THEIR USES GERO PTE. LTD. (SG) 2023-02-16 — — US disclosed
US-11407703-B2 Method for converting hydroxyl group of alcohol TAKASAGO INTERNATIONAL CORPORATION (JP) 2022-08-09 — — US disclosed
US-20220089540-A1 COMPOSITIONS AND METHODS FOR IMMUNE MODULATION AND TREATMENT OF CANCER BOARD OF TRUSTEES OF MICHIGAN STATE UNIVERSITY 2022-03-24 — — US disclosed
EP-3911309-A1 COMPOSITIONS AND METHODS FOR IMMUNE MODULATION AND TREATMENT OF CANCER Board Of Trustees Of Michigan State University (US) 2021-11-24 — — EP disclosed
EP-3792241-A1 METHOD FOR CONVERTING HYDROXYL GROUP OF ALCOHOL Takasago International Corporation (JP) 2021-03-17 — — EP disclosed
US-20210047254-A1 METHOD FOR CONVERTING HYDROXYL GROUP OF ALCOHOL TAKASAGO INTERNATIONAL CORPORATION (JP) 2021-02-18 — — US disclosed
US-6046355-A TOLUENE-4-THIOSULFONIC ACID S-ESTERS AS CHEMICAL INTERMEDIATES FOR VIRICIDES AND ASPARTYL PROTEASE INHIBITORS; AIDS WARNER-LAMBERT COMPANY (US) 2000-04-04 — — US disclosed
WO-2000015634-A2 HIV PROTEASE INHIBITORS WARNER-LAMBERT COMPANY (US) 2000-03-23 — — WO disclosed
EP-0935597-A2 DIHYDROPYRONES WITH IMPROVED ANTIVIRAL ACTIVITY WARNER-LAMBERT COMPANY (US) 1999-08-18 — — EP disclosed
US-5834506-A TREATMENT OF HIV, AIDS; ANTIVIRAL ACTIVITY IMPROVED BY JUDICIOUS PLACEMENT OF POLAR SUBSTITUENTS WARNER-LAMBERT COMPANY (US) 1998-11-10 — — US disclosed
WO-1998019997-A2 DIHYDROPYRONES WITH IMPROVED ANTIVIRAL ACTIVITY WARNER-LAMBERT COMPANY (US) 1998-05-14 — — WO disclosed
US-5145949-A Production process for making aromatic amine resins MITSUI TOATSU CHEMICALS, INC. (JP) 1992-09-08 — — US disclosed
US-5106953-A Reacting aromatic amines with bishalogenomethyl derivatives; curing agents or raw materials for polyamides MITSUI TOATSU CHEMICALS, INC. (JP) 1992-04-21 — — US disclosed
US-5051494-A A bismaleimide and an amino resin MITSUI TOATSU CHEMICALS, INC. (JP) 1991-09-24 — — US disclosed
US-4959443-A HIGH STRENGTH, REACTION OF ARALKYL ALCOHOL AND AROMATIC AMINE MITSUI TOATSU CHEMICALS, INC. (JP) 1990-09-25 — — US disclosed
US-4937318-A Aromatic amine resins MITSUI TOATSU CHEMICALS, INC. (JP) 1990-06-26 — — 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 (5 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-20230047816-A1 PFKFB3 INHIBITORS AND THEIR USES PFKFB3, PFKFB4, PFKFB1 ALDH1A1 1943/4885MAPT 845/4885MEN1 3253/4885
US-20230063462-A1 SULFONIMIDAMIDE COMPOUNDS AND COMPOSITIONS FOR TREATING CONDITIONS ASSOCIATED WITH NLRP ACTIVITY NLRP1, NLRP3, NOD1 ALDH1A1 1806/4885MAPT 2479/4885MEN1 2868/4885
US-11407703-B2 Method for converting hydroxyl group of alcohol ADH1C, CBR1, NAP1L4 ALDH1A1 973/4885MAPT 4792/4885MEN1 2364/4885
US-20220089540-A1 COMPOSITIONS AND METHODS FOR IMMUNE MODULATION AND TREATMENT OF CANCER PDCD1, CD274, PDCD1LG2 ALDH1A1 2112/4885MAPT 2548/4885MEN1 4260/4885
US-20210047254-A1 METHOD FOR CONVERTING HYDROXYL GROUP OF ALCOHOL ADH1C, CBR1, NAP1L4 ALDH1A1 973/4885MAPT 4792/4885MEN1 2364/4885

“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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