SCHEMBL3594857

SCHEMBL3594857

O=C(O)Cc1c(Cl)ccc2ccccc12

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 5/20 0.67
ALDH1A1 P00352 3/20 0.67
HSD17B10 Q99714 2/20 0.67
GAA P10253 2/20 0.67
HPGD P15428 2/20 0.67
GLA P06280 1/20 0.67
AKR1B1 P15121 3/20 0.58
TDP1 Q9NUW8 2/20 0.53
CYP2A6 P11509 1/20 0.47
CYP1A2 P05177 1/20 0.43
CYP2C9 P11712 1/20 0.43
CYP2C19 P33261 1/20 0.43
MAPT P10636 2/20 0.42
CASP1 P29466 1/20 0.42
CASP7 P55210 1/20 0.42
MEN1 O00255 2/20 0.42
KMT2A Q03164 2/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
LMNA P02545 1/20 0.42
HTT P42858 1/20 0.42

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
SCHEMBL9682990 0.80 KDM4E (0.69) KDM4EALDH1A1HSD17B10GAAHPGD
SCHEMBL4889683 0.80 KDM4E (1.00) KDM4EALDH1A1HSD17B10GAAHPGD
SCHEMBL30238199 0.80 KDM4E (0.69) KDM4EALDH1A1HSD17B10GAAHPGD
SCHEMBL29261872 0.79 KDM4E (0.54) KDM4EALDH1A1HSD17B10GAAHPGD
SCHEMBL24821261 0.79 KDM4E (0.67) KDM4EALDH1A1HSD17B10GAAHPGD
SCHEMBL350989 0.79 KDM4E (0.67) KDM4EALDH1A1HSD17B10GAAHPGD
SCHEMBL29669502 0.79 KDM4E (0.67) KDM4EALDH1A1HSD17B10GAAHPGD
SCHEMBL5188827 0.79 KDM4E (0.67) KDM4EALDH1A1HSD17B10GAAHPGD
SCHEMBL6368716 0.79 KDM4E (0.67) KDM4EALDH1A1HSD17B10GAAHPGD
SCHEMBL3763664 0.79 KDM4E (0.67) KDM4EALDH1A1HSD17B10GAAHPGD

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-114868614-A Method for preserving potentilla anserina germplasm resources in field 青海民族大学 2022-08-09 CN disclosed
US-8877779-B2 Benzimidazole compound and pharmaceutical use thereof MITSUBISHI TANABE PHARMA CORPORATION (JP) 2014-11-04 US disclosed
CN-101622241-B Benzimidazole compound and medical application thereof MITSUBISHI TANABE PHARMA CORP 2013-05-22 CN disclosed
US-20100120841-A1 BENZIMIDAZOLE COMPOUND AND PHARMACEUTICAL USE THEREOF MITSUBISHI TANABE PHARMA CORPORATION (JP) 2010-05-13 US disclosed
CN-101622241-A Benzimidazole compound and medical application thereof MITSUBISHI TANABE PHARMA CORP 2010-01-06 CN disclosed
EP-2128154-A1 BENZIMIDAZOLE COMPOUND AND PHARMACEUTICAL USE THEREOF Mitsubishi Tanabe Pharma Corporation (JP) 2009-12-02 EP 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-20100120841-A1 BENZIMIDAZOLE COMPOUND AND PHARMACEUTICAL USE THEREOF ORMDL3, OXA1L, OGFRL1 KDM4E 3547/4885ALDH1A1 63/4885HSD17B10 1983/4885

“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.