Sugi Predict

Sugi Predict / Compounds / SCHEMBL302009

SCHEMBL302009

SCHEMBL302009

[O]c1ccc(Cl)c(Cl)c1Cl

nearest known ligand 0.46

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ CYP3A4 P08684 2/20 0.46
▸ MAPK1 P28482 1/20 0.46
▸ TDP1 Q9NUW8 1/20 0.42
▸ AHR P35869 5/20 0.39
▸ CYP2A6 P11509 2/20 0.35
▸ CES1 P23141 2/20 0.33
▸ MEN1 O00255 1/20 0.32
▸ KMT2A Q03164 1/20 0.32
▸ TSHR P16473 3/20 0.32
▸ CYP1A2 P05177 1/20 0.32
▸ NOTUM Q6P988 2/20 0.31
▸ CYP1B1 Q16678 1/20 0.31
▸ TP53 P04637 1/20 0.30
▸ LMNA P02545 1/20 0.30

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
SCHEMBL348089 0.79 CYP3A4 (0.62) CYP3A4MAPK1TDP1AHRCYP2A6
Methane SCHEMBL23466796 0.75 CYP3A4 (0.59) CYP3A4MAPK1TDP1AHRCYP2A6
SCHEMBL5961683 0.75 CES1 (0.36) CES1LMNA
SCHEMBL329345 0.73 — —
SCHEMBL714058 0.71 CYP3A4 (0.41) CYP3A4MAPK1TDP1AHRCYP2A6
Benzene SCHEMBL186559 0.69 CYP3A4 (0.53) CYP3A4MAPK1TDP1AHRCYP2A6
SCHEMBL10925713 0.69 ALDH1A1 (0.44) MAPK1MEN1KMT2ATSHRLMNA
SCHEMBL9594463 0.69 NOTUM (0.33) MAPK1MEN1KMT2ANOTUM
SCHEMBL9819330 0.69 CYP3A4 (0.59) CYP3A4MAPK1AHRTSHR
SCHEMBL9595483 0.68 SLC2A1 (0.33) —

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118146226-A Pyrrolo [2,3-d ] pyrimidine compound with nitrogen-containing heterocyclic structure, and preparation method and application thereof 贵州大学 2024-06-07 — — CN claimed
CN-118084865-A Pyrimidine compound containing aminopiperidine structure, and preparation method and application thereof 贵州大学 2024-05-28 — — CN claimed
US-11779663-B2 Specific conjugation linkers, specific immunoconjugates thereof, methods of making and uses such conjugates thereof HANGZHOU DAC BIOTECH CO., LTD. (CN) 2023-10-10 — — US claimed
US-20230241241-A1 CONJUGATES OF A CELL-BINDING MOLECULE WITH CAMPTOTHECIN ANALOGS HANGZHOU DAC BIOTECH CO., LTD. (CN) 2023-08-03 — — US claimed
CN-116143678-A Conjugate linker, cell-binding molecule-drug conjugate containing the same, and preparation and application thereof 杭州多禧生物科技有限公司 2023-05-23 — — CN claimed
EP-4168009-A1 CONJUGATES OF A CELL-BINDING MOLECULE WITH CAMPTOTHECIN ANALOGS Hangzhou DAC Biotech Co., Ltd. (CN) 2023-04-26 — — EP claimed
US-20230071112-A1 CONJUGATION LINKERS, CELL BINDING MOLECULE-DRUG CONJUGATES CONTAINING THE LINKERS, METHODS OF MAKING AND USES SUCH CONJUGATES WITH THE LINKERS HANGZHOU DAC BIOTECH CO., LTD. (CN) 2023-03-09 — — US claimed
US-11591275-B2 Smart release potash fertilizer granules RYNAN TECHNOLOGIES PTE LTD (SG) 2023-02-28 — — US claimed
US-20230010108-A1 A CONJUGATION LINKER CONTAINING 2,3-DIAMINOSUCCINYL GROUP HANGZHOU DAC BIOTECH CO., LTD. (CN) 2023-01-12 — — US claimed
US-20230001001-A1 CONJUGATION OF A CYTOTOXIC DRUG WITH BIS-LINKAGE HANGZHOU DAC BIOTECH CO., LTD. (CN) 2023-01-05 — — US claimed
JP-2012500804-A — — 2012-01-12 — — JP claimed
EP-2328619-A2 POLYMERIC BENZYL CARBONATE-DERIVATIVES Baxter International Inc. (US) 2011-06-08 — — EP claimed
CN-101877966-A Farnesoid X receptor agonists SMITHKLINE BEECHAM CORP 2010-11-03 — — CN claimed
US-20100048483-A1 POLYMERIC BENZYL CARBONATE-DERIVATIVES BAXTER HEALTHCARE S.A. (CH) 2010-02-25 — — US claimed
WO-2010022320-A2 POLYMERIC BENZYL CARBONATE-DERIVATIVES BAXTER INTERNATIONAL INC. (US) 2010-02-25 — — WO claimed
CN-1018825-B Process for preparing poly-4-aminopyrrole-2-carboxamido derivatives ERBA FARMITALIA (IT) 1992-10-28 — — CN claimed
EP-0209487-B1 PREPARATION OF COPPER PHTHALOCYANINE IN A PIGMENTARY FORM CIBA-GEIGY AG (CH) 1992-08-05 — — EP claimed
US-4801634-A TRICHLOROPHENOXY COPPER PHTHALOCYANINE, RUBBER OR PLASTIC CIBA-GEIGY CORPORATION (US) 1989-01-31 — — US claimed
US-4801638-A TRICHLOROPHENOXY COPPER PHTHALOCYANINE, PAINT OR INK CIBA-GEIGY CORPORATION (US) 1989-01-31 — — US claimed
US-4694078-A HEAT STABLE CIBA-GEIGY CORPORATION (US) 1987-09-15 — — US claimed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (6 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-20230001001-A1 CONJUGATION OF A CYTOTOXIC DRUG WITH BIS-LINKAGE CD4, MCL1, CCNB1 CYP3A4 1679/4885MAPK1 1789/4885TDP1 1199/4885
US-20230010108-A1 A CONJUGATION LINKER CONTAINING 2,3-DIAMINOSUCCINYL GROUP DAO, DDO, DCLRE1A CYP3A4 2182/4885MAPK1 4194/4885TDP1 2253/4885
US-20100048483-A1 POLYMERIC BENZYL CARBONATE-DERIVATIVES SI, SLC1A5, BCAT1 CYP3A4 302/4885MAPK1 4501/4885TDP1 3674/4885
US-11779663-B2 Specific conjugation linkers, specific immunoconjugates thereof, methods of making and uses such conjugates thereof SLC25A1, GCDH, FH CYP3A4 2674/4885MAPK1 4550/4885TDP1 3693/4885
US-20230241241-A1 CONJUGATES OF A CELL-BINDING MOLECULE WITH CAMPTOTHECIN ANALOGS CD4, DCLRE1A, TOP1 CYP3A4 4501/4885MAPK1 3987/4885TDP1 878/4885
US-20230071112-A1 CONJUGATION LINKERS, CELL BINDING MOLECULE-DRUG CONJUGATES CONTAINING THE LINKERS, METHODS OF MAKING AND USES SUCH CONJUGATES WITH THE LINKERS CD2BP2, DCLRE1A, EPCAM CYP3A4 4282/4885MAPK1 4162/4885TDP1 3362/4885

“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.