SCHEMBL4473108

SCHEMBL4473108

Oc1ccc2ccccc2c1CCl

nearest known ligand 0.70

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSD17B10 Q99714 3/20 0.70
CYP1A2 P05177 3/20 0.70
CYP2C9 P11712 2/20 0.70
CYP2C19 P33261 2/20 0.70
KDM4E B2RXH2 7/20 0.66
ALDH1A1 P00352 6/20 0.66
GAA P10253 6/20 0.66
MAPT P10636 5/20 0.66
TAAR1 Q96RJ0 1/20 0.66
TDP1 Q9NUW8 2/20 0.59
GLA P06280 1/20 0.59
HPGD P15428 1/20 0.59
L3MBTL1 Q9Y468 1/20 0.57
PTPN22 Q9Y2R2 1/20 0.54
CRHBP P24387 1/20 0.53
CRHR2 Q13324 1/20 0.53
KMT2A Q03164 5/20 0.51
CYP2D6 P10635 2/20 0.51
HIF1A Q16665 2/20 0.51
LMNA P02545 1/20 0.51

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
SCHEMBL29357214 0.83 HSD17B10 (1.00) HSD17B10CYP1A2CYP2C9CYP2C19KDM4E
SCHEMBL36762 0.83 HSD17B10 (1.00) HSD17B10CYP1A2CYP2C9CYP2C19KDM4E
SCHEMBL226196 0.83 HSD17B10 (0.76) HSD17B10CYP1A2CYP2C9CYP2C19KDM4E
SCHEMBL761745 0.81 HSD17B10 (0.73) HSD17B10CYP1A2CYP2C9CYP2C19KDM4E
SCHEMBL4019720 0.79 HSD17B10 (0.70) HSD17B10CYP1A2CYP2C9CYP2C19KDM4E
SCHEMBL3361843 0.79 HSD17B10 (0.70) HSD17B10CYP1A2CYP2C9CYP2C19KDM4E
SCHEMBL17799782 0.79 HSD17B10 (0.70) HSD17B10CYP1A2CYP2C9CYP2C19KDM4E
SCHEMBL11660676 0.79 HSD17B10 (0.70) HSD17B10CYP1A2CYP2C9CYP2C19KDM4E
SCHEMBL2452503 0.79 KDM4E (1.00) HSD17B10CYP1A2CYP2C9CYP2C19KDM4E
SCHEMBL13369633 0.79 HSD17B10 (0.70) HSD17B10CYP1A2CYP2C9CYP2C19KDM4E

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-101786934-B Preparation method of aromatic formaldehyde UNIV JIANGXI NORMAL SCI & TECH 2012-10-10 CN disclosed
CN-101786934-A Preparation method of aromatic formaldehyde JIANGXI NORMAL UNIVERSITY OF S 2010-07-28 CN disclosed
US-7582660-B2 2-thio-substituted imidazole derivatives and their use in pharmaceutics C-A-I-R BIOSCIENCES GMBH (DE) 2009-09-01 US disclosed
US-20060235054-A1 2-Thio-substituted imidazole derivatives and their use in pharmaceutics MERCKLE-GMBH (DE) 2006-10-19 US disclosed
EP-1539741-A1 2-THIO-SUBSTITUTED IMIDAZOLE DERIVATIVES AND THEIR USE IN PHARMACEUTICS MERCKLE GMBH (DE) 2005-06-15 EP disclosed
WO-2004018458-A1 2-THIO-SUBSTITUTED IMIDAZOLE DERIVATIVES AND THEIR USE IN PHARMACEUTICS MERCKLE-GMBH (DE) 2004-03-04 WO 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-20060235054-A1 2-Thio-substituted imidazole derivatives and their use in pharmaceutics IL2, TPMT, IFNG HSD17B10 2580/4885CYP1A2 64/4885CYP2C9 161/4885

“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.