SCHEMBL10330772

SCHEMBL10330772

Cc1ccc2c(=O)c(C(=O)O)cn3c2c1OC[C@@H]3C

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TOP2A P11388 4/20 0.59
TOP2B Q02880 4/20 0.59
KDM4E B2RXH2 6/20 0.57
KMT2A Q03164 1/20 0.57
ALDH1A1 P00352 3/20 0.56
HPGD P15428 3/20 0.56
HSD17B10 Q99714 2/20 0.56
ALB P02768 1/20 0.56
HRH3 Q9Y5N1 1/20 0.56
AADAT Q8N5Z0 2/20 0.55
TUBB4A P04350 1/20 0.55
POLB P06746 1/20 0.55
TUBB P07437 1/20 0.55
TUBA3C P0DPH7 1/20 0.55
TUBA1B P68363 1/20 0.55
TUBA4A P68366 1/20 0.55
TUBB4B P68371 1/20 0.55
TUBB3 Q13509 1/20 0.55
TUBB2A Q13885 1/20 0.55
TUBB8 Q3ZCM7 1/20 0.55

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
SCHEMBL11858912 1.00 TOP2A (0.59) TOP2ATOP2BKDM4EKMT2AALDH1A1
SCHEMBL2080556 0.89 TOP2A (0.66) TOP2ATOP2BKDM4EKMT2AALDH1A1
SCHEMBL2080555 0.89 TOP2A (0.66) TOP2ATOP2BKDM4EKMT2AALDH1A1
SCHEMBL9144791 0.87 TOP2A (0.58) TOP2ATOP2BKDM4EKMT2AALDH1A1
SCHEMBL15828720 0.84 TOP2A (0.57) TOP2ATOP2BKDM4EKMT2AALDH1A1
SCHEMBL10903306 0.84 TOP2A (0.57) TOP2ATOP2BKDM4EKMT2AALDH1A1
SCHEMBL10330773 0.84 CNR2 (0.49) TOP2ATOP2BKDM4EKMT2AALDH1A1
SCHEMBL11295629 0.83 KDM4E (0.56) TOP2ATOP2BKDM4EKMT2AALDH1A1
SCHEMBL10530423 0.82 TOP2A (0.70) TOP2ATOP2BKDM4EKMT2AALDH1A1
SCHEMBL15502452 0.81 KDM4E (0.68) TOP2ATOP2BKDM4EKMT2AALDH1A1

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-8222407-B2 Mutilin derivative having heterocyclic aromatic ring carboxylic acid structure in substituent at 14-position KYORIN PHARMACEUTICAL CO., LTD. (JP) 2012-07-17 US disclosed
US-8222407-B2 Mutilin derivative having heterocyclic aromatic ring carboxylic acid structure in substituent at 14-position KYORIN PHARMACEUTICAL CO., LTD. (JP) 2012-07-17 US disclosed
US-7902226-B2 Dehalogeno-compounds DAIICHI PHARMACEUTICAL CO., LTD. (JP) 2011-03-08 US disclosed
US-7902226-B2 Dehalogeno-compounds DAIICHI PHARMACEUTICAL CO., LTD. (JP) 2011-03-08 US disclosed
US-20100197909-A1 MUTILIN DERIVATIVE HAVING HETEROCYCLIC AROMATIC RING CARBOXYLIC ACID STRUCTURE IN SUBTITUENT AT 14-POSITION KYORIN PHARMACEUTICAL CO., LTD. (JP) 2010-08-05 US disclosed
US-20100197909-A1 MUTILIN DERIVATIVE HAVING HETEROCYCLIC AROMATIC RING CARBOXYLIC ACID STRUCTURE IN SUBTITUENT AT 14-POSITION KYORIN PHARMACEUTICAL CO., LTD. (JP) 2010-08-05 US disclosed
US-20070123560-A1 Dehalogeno-compounds DAIICHI PHARMACEUTICAL CO., LTD. 2007-05-31 US disclosed
US-20070123560-A1 Dehalogeno-compounds DAIICHI PHARMACEUTICAL CO., LTD. 2007-05-31 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-20070123560-A1 Dehalogeno-compounds DEK, RPS27L, POLL TOP2A 228/4885TOP2B 555/4885KDM4E 2618/4885
US-20100197909-A1 MUTILIN DERIVATIVE HAVING HETEROCYCLIC AROMATIC RING CARBOXYLIC ACID STRUCTURE IN SUBTITUENT AT 14-POSITION PELP1, MLN, SND1 TOP2A 3897/4885TOP2B 4117/4885KDM4E 3997/4885

“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.