SCHEMBL2477392

SCHEMBL2477392

CC(C)Nc1ncnc2c(-c3ccc(O)cc3)csc12

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPK1 P28482 2/20 0.41
▸ MEN1 O00255 1/20 0.41
▸ MAPT P10636 1/20 0.41
▸ KMT2A Q03164 1/20 0.41
▸ FGFR1 P11362 3/20 0.41
▸ LPAR2 Q9HBW0 2/20 0.40
▸ LMNA P02545 1/20 0.39
▸ HTT P42858 1/20 0.39
▸ SMN1; SMN2 Q16637 1/20 0.39
▸ USP7 Q93009 1/20 0.39
▸ CD38 P28907 1/20 0.38
▸ MCL1 Q07820 1/20 0.37
▸ TYR P14679 1/20 0.36
▸ GPR119 Q8TDV5 2/20 0.35
▸ CCNB2 O95067 1/20 0.35
▸ CDK1 P06493 1/20 0.35
▸ CCNB1 P14635 1/20 0.35
▸ CCNB3 Q8WWL7 1/20 0.35
▸ EGFR P00533 3/20 0.35
▸ CYP17A1 P05093 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
SCHEMBL15214852 0.88 LPAR2 (0.42) MEN1MAPTKMT2AFGFR1LPAR2
SCHEMBL15214864 0.87 LPAR2 (0.40) MAPTLPAR2LMNAHTTSMN1; SMN2
SCHEMBL10176269 0.85 LPAR2 (0.39) MAPK1LPAR2HTTCD38GPR119
SCHEMBL2476576 0.74 LMNA (0.43) LPAR2LMNAHTTSMN1; SMN2CD38
SCHEMBL27410321 0.74 LPAR2 (0.51) MAPK1MAPTLPAR2
SCHEMBL22750924 0.68 LMNA (0.51) MAPK1MEN1MAPTKMT2AFGFR1
SCHEMBL2473849 0.68 KMT2A (0.50) MAPK1MEN1MAPTKMT2ALMNA
SCHEMBL23580747 0.66 PDPK1 (0.53) MAPK1FGFR1LMNAHTTSMN1; SMN2
SCHEMBL31336899 0.66 PDPK1 (0.53) MAPK1FGFR1LMNAHTTSMN1; SMN2
SCHEMBL14478872 0.65 FGFR1 (0.60) MAPK1MEN1MAPTKMT2AFGFR1

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 12 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2373163-B1 HETEROCYCLIC COMPOUNDS AND METHODS OF USE GENENTECH INC (US) 2015-06-10 — — EP disclosed
EP-2373163-B1 HETEROCYCLIC COMPOUNDS AND METHODS OF USE GENENTECH INC (US) 2015-06-10 — — EP disclosed
CN-102316733-B Heterocyclic compounds and methods of use GENENTECH INC 2014-01-01 — — CN disclosed
US-8232273-B2 Heterocyclic compounds and methods of use GENENTECH, INC. (US) 2012-07-31 — — US disclosed
US-8232273-B2 Heterocyclic compounds and methods of use GENENTECH, INC. (US) 2012-07-31 — — US disclosed
US-8232273-B2 Heterocyclic compounds and methods of use GENENTECH, INC. (US) 2012-07-31 — — US disclosed
EP-2373163-A1 HETEROCYCLIC COMPOUNDS AND METHODS OF USE Genentech, Inc. (US) 2011-10-12 — — EP disclosed
US-20100210622-A1 HETEROCYCLIC COMPOUNDS AND METHODS OF USE ABBVIE INC. 2010-08-19 — — US disclosed
US-20100210622-A1 HETEROCYCLIC COMPOUNDS AND METHODS OF USE ABBVIE INC. 2010-08-19 — — US disclosed
US-20100210622-A1 HETEROCYCLIC COMPOUNDS AND METHODS OF USE ABBVIE INC. 2010-08-19 — — US disclosed
WO-2010080503-A1 HETEROCYCLIC COMPOUNDS AND METHODS OF USE GENENTECH, INC. (US) 2010-07-15 — — WO disclosed
WO-2010080503-A1 HETEROCYCLIC COMPOUNDS AND METHODS OF USE GENENTECH, INC. (US) 2010-07-15 — — 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 (1 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-20100210622-A1 HETEROCYCLIC COMPOUNDS AND METHODS OF USE BCL2A1, BAX, BCL2 MAPK1 3160/4885MEN1 833/4885MAPT 4846/4885

“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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