SCHEMBL1572345

SCHEMBL1572345

Cc1ccc(Cl)cc1.Cc1cccc(C)c1Cl

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CES2 O00748 1/20 0.46
CES1 P23141 1/20 0.46
ACHE P22303 3/20 0.40
CYP2A6 P11509 3/20 0.40
LMNA P02545 1/20 0.40
TDP1 Q9NUW8 1/20 0.40
BCHE P06276 1/20 0.39
NPC1 O15118 1/20 0.38
RAB9A P51151 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
MEN1 O00255 1/20 0.38
KMT2A Q03164 1/20 0.38
MGAM O43451 1/20 0.38
GAA P10253 1/20 0.38
SI P14410 1/20 0.38
MGAM2 Q2M2H8 1/20 0.38
CYP1A2 P05177 3/20 0.38
NR1H4 Q96RI1 1/20 0.37
PTGS2 P35354 1/20 0.37
CYP19A1 P11511 1/20 0.37

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
SCHEMBL144551 0.84
SCHEMBL10555486 0.81 ALDH1A1 (0.64) CES2CES1ACHELMNANPC1
SCHEMBL4755295 0.81 CYP2A6 (0.47) ACHECYP2A6TDP1CYP1A2TSHR
SCHEMBL1317463 0.81 CYP2A6 (0.47) ACHECYP2A6TDP1CYP1A2TSHR
SCHEMBL6203955 0.81
SCHEMBL12679 0.81
1,4-Dichlorobenzene SCHEMBL6273412 0.80 TSHR (0.42) ACHECYP2A6LMNANPC1RAB9A
SCHEMBL10736300 0.78 CES2 (0.45) CES2CES1ACHECYP2A6LMNA
Bromide SCHEMBL28687084 0.78 CES2 (0.59) CES2CES1ACHECYP2A6LMNA
Phosphine SCHEMBL22129260 0.78

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1818332-B1 PROCESS FOR PRODUCING EPOXYTRIAZOLE DERIVATIVE SUMITOMO CHEMICAL CO (JP) 2011-04-13 EP disclosed
US-7569699-B2 Process for producing epoxytriazole derivative SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2009-08-04 US disclosed
US-20080081915-A1 Process For Producing Epoxytriazole Derivative SUMITOMO CHEMICAL COMPANY, LIMITED 2008-04-03 US disclosed
EP-1818332-A1 PROCESS FOR PRODUCING EPOXYTRIAZOLE DERIVATIVE Sumitomo Chemical Company, Limited (JP) 2007-08-15 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-20080081915-A1 Process For Producing Epoxytriazole Derivative CYP2E1, CYP1A1, SULT1A1 CES2 796/4885CES1 750/4885ACHE 3331/4885

“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.