SCHEMBL6292875

SCHEMBL6292875

Cc1ccc2cc(C(=O)O)oc2c1C

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MCL1 Q07820 1/20 0.49
PIM1 P11309 6/20 0.43
CSNK2A1 P68400 3/20 0.42
CSNK2A2 P19784 2/20 0.42
CSNK2B P67870 2/20 0.42
CSNK2A3 Q8NEV1 2/20 0.42
KDM4E B2RXH2 3/20 0.42
KMT2A Q03164 2/20 0.42
HPGD P15428 2/20 0.41
MEN1 O00255 1/20 0.41
ALDH1A1 P00352 1/20 0.41
GPR35 Q9HC97 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
LMNA P02545 1/20 0.40
TP53 P04637 1/20 0.40
GLA P06280 1/20 0.39
MAPT P10636 1/20 0.39
TSHR P16473 1/20 0.39
HTT P42858 1/20 0.39
HSD17B10 Q99714 1/20 0.39

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
SCHEMBL11741038 0.83 DAO (0.46) MCL1PIM1CSNK2A1CSNK2A2CSNK2B
SCHEMBL10801943 0.80 PIM1 (0.56) PIM1KDM4EKMT2AHPGDMEN1
SCHEMBL2432723 0.79 MAOB (0.53) MCL1PIM1KDM4EKMT2AHPGD
SCHEMBL5772064 0.79 PIM1 (0.46) PIM1CSNK2A1CSNK2A2CSNK2BCSNK2A3
SCHEMBL27843491 0.76 PIM1 (0.51) PIM1KDM4EKMT2AGPR35PIM2
SCHEMBL17843583 0.74 RARA (0.50) MCL1PIM1CSNK2A1CSNK2A2CSNK2B
SCHEMBL11740084 0.73 KMT2A (0.52) PIM1KDM4EKMT2AHPGDMEN1
SCHEMBL17864632 0.73 MCL1 (0.46) MCL1PIM1CSNK2A1CSNK2A2CSNK2B
SCHEMBL19519553 0.72 HSD17B3 (0.49) MCL1KMT2AMEN1GPR35
SCHEMBL11830321 0.71 CSNK2A1 (0.59) MCL1PIM1CSNK2A1CSNK2A2CSNK2B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6869953-B2 N-monoacylated derivatives of o-phenylenediamines, their analogs and their use as pharmaceutical agents HOFFMAN-LA ROCHE INC. (US) 2005-03-22 US claimed
US-20040192744-A1 N-monoacylated derivatives of o-phenylenediamines, their analogs and their use as pharmaceutical agents HAAG RAINER (DE) 2004-09-30 US claimed
US-20030139404-A1 N-monoacylated derivatives of o-phenylenediamines, their analogs and their use as pharmaceutical agents HOFFMANN-LA ROCHE INC. 2003-07-24 US claimed
US-6946462-B2 N-monoacylated derivatives of o-phenylenediamines, their analogs and their use as pharmaceutical agents HOFFMANN-LA ROCHE INC. (US) 2005-09-20 US disclosed
US-6869953-B2 N-monoacylated derivatives of o-phenylenediamines, their analogs and their use as pharmaceutical agents HOFFMAN-LA ROCHE INC. (US) 2005-03-22 US disclosed
US-4009994-A Process and product of optical brightening with quaternized benzofuranyl-benzimidazoles CIBA-GEIGY CORPORATION (US) 1977-03-01 US disclosed
US-3940417-A Quaternised benzofuranyl-benzimidazoles CIBA-GEIGY CORPORATION (US) 1976-02-24 US disclosed
US-3931239-A DIURETIC, HYPOTENSIVE MERCK & CO., INC. (US) 1976-01-06 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 (2 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-20040192744-A1 N-monoacylated derivatives of o-phenylenediamines, their analogs and their use as pharmaceutical agents NAT1, CYP1A1, UGT1A1 MCL1 994/4885PIM1 1801/4885CSNK2A1 1081/4885
US-20030139404-A1 N-monoacylated derivatives of o-phenylenediamines, their analogs and their use as pharmaceutical agents NAT1, CYP1A1, UGT1A1 MCL1 994/4885PIM1 1801/4885CSNK2A1 1081/4885

“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.