SCHEMBL2947873

SCHEMBL2947873

Cc1ccccc1-c1ccc(C(N)=O)c(C=O)c1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MCL1 Q07820 1/20 0.49
ERN1 O75460 6/20 0.43
CTSD P07339 1/20 0.41
BACE1 P56817 1/20 0.41
ALDH1A1 P00352 3/20 0.41
TSHR P16473 2/20 0.41
LMNA P02545 1/20 0.40
HPGD P15428 1/20 0.40
HTT P42858 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
BCAT2 O15382 1/20 0.40
MKNK1 Q9BUB5 1/20 0.40
MKNK2 Q9HBH9 1/20 0.40
LCK P06239 1/20 0.40
KDR P35968 1/20 0.40
JAK3 P52333 1/20 0.40
MAPK14 Q16539 1/20 0.40
CA12 O43570 1/20 0.40
CA1 P00915 1/20 0.40
CA2 P00918 1/20 0.40

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
SCHEMBL3971606 0.81 MCL1 (0.58) MCL1ERN1ALDH1A1TSHR
SCHEMBL2955600 0.80 MCL1 (0.44) MCL1ERN1CTSDBACE1ALDH1A1
SCHEMBL5737521 0.75 MCL1 (0.54) MCL1ERN1CTSDBACE1ALDH1A1
SCHEMBL28785573 0.75 CHEK1 (0.47) MCL1ERN1ALDH1A1TSHRLMNA
SCHEMBL14289910 0.74 SRC (0.50) ERN1ALDH1A1HPGD
SCHEMBL7936530 0.73 ERN1 (0.51) ERN1ALDH1A1TSHR
SCHEMBL7166417 0.72 MCL1 (0.52) MCL1ERN1CA12CA1CA2
SCHEMBL3689077 0.72 ALOX5AP (0.46) MCL1ERN1CTSDBACE1ALDH1A1
SCHEMBL28356802 0.72 CTSD (0.49) MCL1CTSDBACE1ALDH1A1TSHR
SCHEMBL23645732 0.72 MCL1 (0.50) MCL1BCAT2MKNK1MKNK2CA12

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1856058-B1 PHTHALAZINE, AZA- AND DIAZA-PHTHALAZINE COMPOUNDS AND METHODS OF USE AMGEN INC (US) 2014-09-03 EP disclosed
US-7759337-B2 Phthalazine compounds and methods of use AMGEN INC. (US) 2010-07-20 US disclosed
EP-1856058-A2 PHTHALAZINE, AZA- AND DIAZA-PHTHALAZINE COMPOUNDS AND METHODS OF USE Amgen Inc. (US) 2007-11-21 EP disclosed
WO-2006094187-A2 PHTHALAZINE, AZA- AND DIAZA-PHTHALAZINE COMPOUNDS AND METHODS OF USE AMGEN INC (US) 2006-09-08 WO disclosed
US-20060199817-A1 Phthalazine, aza- and diaza-phthalazine compounds and methods of use AMGEN INC. (US) 2006-09-07 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 (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-20060199817-A1 Phthalazine, aza- and diaza-phthalazine compounds and methods of use DAPK2, CDK2, DAPK1 MCL1 1410/4885ERN1 3060/4885CTSD 4287/4885

“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.