SCHEMBL5843250

SCHEMBL5843250

Cc1cc(Cl)c(C)c(Cl)n1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 2/20 0.43
▸ MAPK1 P28482 2/20 0.43
▸ SMN1; SMN2 Q16637 1/20 0.43
▸ POLB P06746 3/20 0.42
▸ LMNA P02545 1/20 0.42
▸ MAPT P10636 3/20 0.41
▸ L3MBTL1 Q9Y468 2/20 0.38
▸ KMT2A Q03164 2/20 0.37
▸ MEN1 O00255 1/20 0.37
▸ HTT P42858 2/20 0.35
▸ HPGD P15428 2/20 0.35
▸ APOBEC3G Q9HC16 1/20 0.35
▸ PDE10A Q9Y233 1/20 0.34
▸ NR4A2 P43354 1/20 0.34
▸ APAF1 O14727 1/20 0.34
▸ ALOX15 P16050 1/20 0.34
▸ HK1 P19367 1/20 0.34
▸ CASP1 P29466 1/20 0.34
▸ MPI P34949 1/20 0.34
▸ CASP7 P55210 1/20 0.34

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
SCHEMBL29892233 1.00 ALDH1A1 (0.43) ALDH1A1MAPK1SMN1; SMN2POLBLMNA
SCHEMBL10411734 0.79 SMN1; SMN2 (0.54) ALDH1A1MAPK1SMN1; SMN2POLBL3MBTL1
SCHEMBL10639171 0.79 PDE10A (0.34) ALDH1A1MAPK1SMN1; SMN2LMNAKMT2A
SCHEMBL11985884 0.79 LMNA (0.42) ALDH1A1MAPK1SMN1; SMN2POLBLMNA
SCHEMBL2091242 0.79 LMNA (0.47) ALDH1A1MAPK1SMN1; SMN2POLBLMNA
SCHEMBL1886976 0.77 POLB (0.45) ALDH1A1MAPK1SMN1; SMN2POLBLMNA
SCHEMBL30124712 0.77 POLB (0.45) ALDH1A1MAPK1SMN1; SMN2POLBLMNA
SCHEMBL26617136 0.75 ALDH1A1 (0.41) ALDH1A1MAPK1SMN1; SMN2POLBLMNA
SCHEMBL26608375 0.75 ALDH1A1 (0.41) ALDH1A1MAPK1SMN1; SMN2POLBLMNA
SCHEMBL20260106 0.75 SMN1; SMN2 (0.41) ALDH1A1MAPK1SMN1; SMN2POLBLMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117263942-A SHP2 phosphatase inhibitors and methods of use thereof 传达治疗有限公司 2023-12-22 — — CN disclosed
EP-4273147-A1 SUBSTITUTED SPIROLACTAMS, SALTS THEREOF AND THEIR USE AS HERBICIDALLY ACTIVE SUBSTANCES Bayer Aktiengesellschaft (DE) 2023-11-08 — — EP disclosed
CN-112166110-B SHP2 phosphatase inhibitors and methods of use thereof 传达治疗有限公司 2023-08-11 — — CN disclosed
US-20230234958-A1 SHP2 PHOSPHATASE INHIBITORS AND METHODS OF USE THEREOF D. E. SHAW RESEARCH, LLC 2023-07-27 — — US disclosed
US-20230234958-A1 SHP2 PHOSPHATASE INHIBITORS AND METHODS OF USE THEREOF D. E. SHAW RESEARCH, LLC 2023-07-27 — — US disclosed
US-20220340576-A1 SHP2 PHOSPHATASE INHIBITORS AND METHODS OF USE THEREOF RELAY THERAPEUTICS, INC. 2022-10-27 — — US disclosed
US-20220315586-A1 SHP2 PHOSPHATASE INHIBITORS AND METHODS OF USE THEREOF SCHRODINGER, INC. 2022-10-06 — — US disclosed
US-11304929-B2 Tosylacetate based compounds and derivatives thereof as PHGDH inhibitors BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2022-04-19 — — US disclosed
US-20220008386-A1 TOSYLACETATE BASED COMPOUNDS AND DERIVATIVES THEREOF AS PHGDH INHIBITORS BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2022-01-13 — — US disclosed
US-10934302-B1 SHP2 phosphatase inhibitors and methods of use thereof RELAY THERAPEUTICS, INC. (US) 2021-03-02 — — US disclosed
EP-0832067-B1 PROCESS FOR CONVERTING 2,4-DICHLOROPYRIDINES INTO 2-ARYLOXY-4-CHLOROPYRIDINES PFIZER (US) 2003-07-02 — — EP disclosed
US-6316631-B1 REACTING 2,4-DICHLORO-3,6-DIALKYLPYRIDINE WITH PHENOL DERIVATIVE IN PRESENCE OF BASE AND COPPER CHLORIDE OR COPPER IODIDE OR COPPER BROMIDE TO FORM 2-ARYLOXY-4-CHLOROPYRIDINE COMPOUND, SALT FOMATION PFIZER INC. 2001-11-13 — — US disclosed
EP-0764166-B1 CORTICOTROPIN RELEASING FACTOR ANTAGONISTS PFIZER (US) 2000-09-13 — — EP disclosed
US-6043260-A Method of treating heart failure PFIZER INC (US) 2000-03-28 — — US disclosed
EP-0951906-A1 Use of 3,6-dimethyl-2-(2,4,6-trimethylphenoxy)-pyridines for treating heart failure Pfizer Products Inc. (US) 1999-10-27 — — EP disclosed
US-5962479-A Corticotropin releasing factor antagonists PFIZER INC. (US) 1999-10-05 — — US disclosed
EP-0832067-A1 PROCESS FOR CONVERTING 2,4-DICHLOROPYRIDINES INTO 2-ARYLOXY-4-CHLOROPYRIDINES PFIZER INC. (US) 1998-04-01 — — EP disclosed
EP-0764166-A1 CORTICOTROPIN RELEASING FACTOR ANTAGONISTS PFIZER INC. (US) 1997-03-26 — — EP disclosed
WO-1996039388-A1 PROCESS FOR CONVERTING 2,4-DICHLOROPYRIDINES INTO 2-ARYLOXY-4-CHLOROPYRIDINES PFIZER INC. (US) 1996-12-12 — — WO disclosed
WO-1995033750-A1 CORTICOTROPIN RELEASING FACTOR ANTAGONISTS PFIZER INC. (US) 1995-12-14 — — 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 (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-20220340576-A1 SHP2 PHOSPHATASE INHIBITORS AND METHODS OF USE THEREOF PTPRCAP, PTPN22, PTPN1 ALDH1A1 3280/4885MAPK1 458/4885SMN1; SMN2 2967/4885
US-20230234958-A1 SHP2 PHOSPHATASE INHIBITORS AND METHODS OF USE THEREOF PTPRCAP, PTPN22, PTPN1 ALDH1A1 3280/4885MAPK1 458/4885SMN1; SMN2 2967/4885
US-11304929-B2 Tosylacetate based compounds and derivatives thereof as PHGDH inhibitors PHGDH, G6PD, PHPT1 ALDH1A1 168/4885MAPK1 316/4885SMN1; SMN2 4482/4885
US-10934302-B1 SHP2 phosphatase inhibitors and methods of use thereof PTPRCAP, PTPRJ, PTPRC ALDH1A1 3858/4885MAPK1 769/4885SMN1; SMN2 2591/4885
US-20220008386-A1 TOSYLACETATE BASED COMPOUNDS AND DERIVATIVES THEREOF AS PHGDH INHIBITORS PHGDH, G6PD, PHPT1 ALDH1A1 168/4885MAPK1 316/4885SMN1; SMN2 4482/4885
US-20220315586-A1 SHP2 PHOSPHATASE INHIBITORS AND METHODS OF USE THEREOF PTPRCAP, PTPN22, PTPN1 ALDH1A1 3280/4885MAPK1 458/4885SMN1; SMN2 2967/4885

“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.

Send feedback