SCHEMBL11222115

SCHEMBL11222115

Cc1cc(Cl)c2c(c1)C(=O)c1ccccc1C2=O

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TTR P02766 3/20 0.58
CYP1A1 P04798 1/20 0.56
CYP1A2 P05177 1/20 0.56
ELANE P08246 3/20 0.55
KMT2A Q03164 5/20 0.47
MEN1 O00255 4/20 0.47
ALDH1A1 P00352 3/20 0.47
MAPT P10636 2/20 0.47
TDP1 Q9NUW8 2/20 0.47
CYP3A4 P08684 2/20 0.47
TSHR P16473 2/20 0.47
MAPK1 P28482 2/20 0.47
KDM4E B2RXH2 1/20 0.47
USP2 O75604 1/20 0.47
BRCA1 P38398 1/20 0.47
RECQL P46063 1/20 0.47
BCL2 P10415 2/20 0.44
MCL1 Q07820 2/20 0.44
ADORA2A P29274 1/20 0.44
CDC25B P30305 1/20 0.44

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
SCHEMBL1712245 0.93 ELANE (0.55) TTRCYP1A1CYP1A2ELANEKMT2A
SCHEMBL6905214 0.82 TTR (0.64) TTRCYP1A1CYP1A2KMT2AMEN1
SCHEMBL985103 0.81 TTR (0.62) TTRCYP1A1CYP1A2ELANEKMT2A
SCHEMBL14124313 0.78 ELANE (0.55) TTRCYP1A1CYP1A2ELANEKMT2A
SCHEMBL11640489 0.78 TTR (0.58) TTRCYP1A2ELANEKMT2AMEN1
SCHEMBL9846479 0.78 TTR (0.58) TTRCYP1A1CYP1A2KMT2AMEN1
Pachybasin SCHEMBL7624909 0.78 MAPT (0.75) TTRCYP1A1CYP1A2ELANEKMT2A
Pachybasin SCHEMBL31536859 0.78 MAPT (0.75) TTRCYP1A1CYP1A2ELANEKMT2A
SCHEMBL29191819 0.78 TTR (0.58) TTRCYP1A1CYP1A2ELANEKMT2A
SCHEMBL11404943 0.78 CYP1A1 (0.51) TTRCYP1A1CYP1A2ELANEKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-107744795-A A kind of hydrogenation-dechlorination catalyst converter 徐州工程学院 2018-03-02 CN disclosed
US-9096536-B2 Asymmetrically substituted anthrapyridazone derivatives as cytostatics BS-154 S.P. ZO.O. (PL) 2015-08-04 US disclosed
EP-2697205-A1 ASYMMETRICALLY SUBSTITUTED ANTHRAPYRIDAZONE DERIVATIVES AS CYTOSTATICS BS-154 SP. Z O.O. (PL) 2014-02-19 EP disclosed
US-20140031357-A1 ASYMMETRICALLY SUBSTITUTED ANTHRAPYRIDAZONE DERIVATIVES AS CYTOSTATICS BS-154 SP. Z O.O. (PL) 2014-01-30 US disclosed
WO-2012141604-A1 ASYMMETRICALLY SUBSTITUTED ANTHRAPYRIDAZONE DERIVATIVES AS CYTOSTATICS INSTYTUT FARMACEUTYCZNY (PL) 2012-10-18 WO disclosed
US-4355012-A Mixed anthraquinonedisulfonic acids AMERICAN COLOR & CHEMICAL CORPORATION (US) 1982-10-19 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-20140031357-A1 ASYMMETRICALLY SUBSTITUTED ANTHRAPYRIDAZONE DERIVATIVES AS CYTOSTATICS ABCC1, ABCC3, ABCB1 TTR 4656/4885CYP1A1 866/4885CYP1A2 895/4885

“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.