SCHEMBL1144846

SCHEMBL1144846

CCc1n[nH]c2ccc(C(=O)O)cc12

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAP2K4 P45985 6/20 0.50
▸ MAPK1 P28482 4/20 0.50
▸ MAPK6 Q16659 4/20 0.50
▸ MAPKAPK3 Q16644 3/20 0.50
▸ KMT2A Q03164 2/20 0.50
▸ MEN1 O00255 1/20 0.50
▸ NPC1 O15118 1/20 0.50
▸ RAB9A P51151 1/20 0.50
▸ KDM4E B2RXH2 3/20 0.46
▸ ALDH1A1 P00352 2/20 0.46
▸ THRB P10828 1/20 0.46
▸ HPGD P15428 1/20 0.46
▸ TTR P02766 1/20 0.44
▸ PPARG P37231 1/20 0.43
▸ PSMD14 O00487 1/20 0.43
▸ RECQL P46063 1/20 0.43
▸ RXFP1 Q9HBX9 1/20 0.43
▸ TDP1 Q9NUW8 1/20 0.43
▸ ITK Q08881 1/20 0.42
▸ JAK2 O60674 1/20 0.42

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
SCHEMBL1144988 0.88 KDM4E (0.50) MAP2K4MAPK1MAPK6MAPKAPK3KMT2A
SCHEMBL3603415 0.88 KMT2A (0.50) MAP2K4MAPK1MAPK6MAPKAPK3KMT2A
SCHEMBL15172582 0.84 MAP2K4 (0.47) MAP2K4MAPK1MAPK6MAPKAPK3KDM4E
SCHEMBL4781046 0.84 JAK2 (0.48) MAP2K4MAPK1MAPK6MAPKAPK3KDM4E
SCHEMBL17514161 0.84 MAP2K4 (0.47) MAP2K4MAPK1MAPK6MAPKAPK3KMT2A
SCHEMBL4149673 0.84 JAK2 (0.40) MAP2K4MAPK1MAPK6MAPKAPK3KMT2A
SCHEMBL4899295 0.84 MEN1 (0.50) MAP2K4MAPK1KMT2AMEN1NPC1
SCHEMBL19328981 0.82 PARP1 (0.48) KMT2AMEN1NPC1RAB9AKDM4E
SCHEMBL6753577 0.79 MAP2K4 (0.43) MAP2K4MAPK1MAPK6MAPKAPK3KDM4E
SCHEMBL31504557 0.79 MAP2K4 (0.57) MAP2K4MAPK1MAPK6MAPKAPK3KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2952514-A1 N1/N2-LACTAM ACETYL-COA CARBOXYLASE INHIBITORS Pfizer Inc (US) 2015-12-09 — — EP disclosed
US-9181252-B2 N1/N2-lactam acetyl-CoA carboxylase inhibitors PFIZER INC. (US) 2015-11-10 — — US disclosed
CN-104774205-A N1/N2-lactam acetyl-coa carboxylase inhibitors PFIZER 2015-07-15 — — CN disclosed
EP-2297163-B1 Pyrazolospiroketone acetyl-CoA carboxylase inhibitors PFIZER (US) 2015-07-08 — — EP disclosed
EP-2297163-B1 Pyrazolospiroketone acetyl-CoA carboxylase inhibitors PFIZER (US) 2015-07-08 — — EP disclosed
US-20150152109-A1 N1/N2-LACTAM ACETYL-COA CARBOXYLASE INHIBITORS PFIZER INC. (US) 2015-06-04 — — US disclosed
EP-2632925-B1 N1/N2-LACTAM ACETYL-CoA CARBOXYLASE INHIBITORS PFIZER (US) 2015-05-27 — — EP disclosed
US-8993586-B2 N1/N2-lactam acetyl-CoA carboxylase inhibitors PFIZER INC. (US) 2015-03-31 — — US disclosed
CN-103189377-B N1/n2-lactam acetyl-coa carboxylase inhibitors PFIZER 2015-02-25 — — CN disclosed
US-20150025098-A1 N1/N2-LACTAM ACETYL-COA CARBOXYLASE INHIBITORS PFIZER INC. (US) 2015-01-22 — — US disclosed
US-20080255145-A1 Thiadiazole compounds and methods of use AMGEN INC. (US) 2008-10-16 — — US disclosed
US-20080255145-A1 Thiadiazole compounds and methods of use AMGEN INC. (US) 2008-10-16 — — US disclosed
US-20080255145-A1 Thiadiazole compounds and methods of use AMGEN INC. (US) 2008-10-16 — — US disclosed
US-20080242694-A1 Amino-substituted heterocycles, compositions thereof, and methods of treatment therewith D SIDOCKY NEIL R 2008-10-02 — — US disclosed
US-7354944-B2 Thiadiazole compounds and methods of use AMGEN INC. (US) 2008-04-08 — — US disclosed
US-7354944-B2 Thiadiazole compounds and methods of use AMGEN INC. (US) 2008-04-08 — — US disclosed
US-7354944-B2 Thiadiazole compounds and methods of use AMGEN INC. (US) 2008-04-08 — — US disclosed
US-20060154961-A1 Thiadiazole compounds and methods of use AMGEN INC. 2006-07-13 — — US disclosed
CN-1080260-C Substituted indazole derivatives and their use as phosphodiesterase (PDE) type IV and tumor necrosis factor (TNF) inhibitors PFIZER (US) 2002-03-06 — — CN disclosed
CN-1223651-A Substituted indazole derivatives and their use as phosphodiesterase (PDE) type IV and tumor necrosis factor (TNF) inhibitors PFIZER (US) 1999-07-21 — — CN 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-20150025098-A1 N1/N2-LACTAM ACETYL-COA CARBOXYLASE INHIBITORS ACACA, ACACB, COASY MAP2K4 4480/4885MAPK1 3158/4885MAPK6 4103/4885
US-20150152109-A1 N1/N2-LACTAM ACETYL-COA CARBOXYLASE INHIBITORS ACACA, ACACB, COASY MAP2K4 4480/4885MAPK1 3158/4885MAPK6 4103/4885
US-20080255145-A1 Thiadiazole compounds and methods of use PDK2, PDK1, PANK2 MAP2K4 468/4885MAPK1 264/4885MAPK6 218/4885
US-20080242694-A1 Amino-substituted heterocycles, compositions thereof, and methods of treatment therewith JAK2, CHEK2, MTOR MAP2K4 1105/4885MAPK1 115/4885MAPK6 136/4885
US-20060154961-A1 Thiadiazole compounds and methods of use PDK2, PDK1, PANK2 MAP2K4 468/4885MAPK1 264/4885MAPK6 218/4885

“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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