SCHEMBL6742873

SCHEMBL6742873

Cc1ccc(O)c(C(=O)CCCl)c1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 5/20 0.56
KMT2A Q03164 5/20 0.56
RAB9A P51151 4/20 0.56
KDM4E B2RXH2 4/20 0.56
LMNA P02545 3/20 0.56
POLB P06746 1/20 0.56
CSNK2A1 P68400 1/20 0.56
HPGD P15428 4/20 0.49
MAPT P10636 3/20 0.49
HTT P42858 3/20 0.49
SMN1; SMN2 Q16637 2/20 0.49
NPSR1 Q6W5P4 2/20 0.49
NPC1 O15118 2/20 0.49
TSHR P16473 2/20 0.49
HSD17B10 Q99714 2/20 0.49
PLA2G1B P04054 1/20 0.49
XBP1 P17861 1/20 0.49
ALOX12 P18054 1/20 0.49
KCNH2 Q12809 1/20 0.49
ATG4B Q9Y4P1 1/20 0.49

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
SCHEMBL29773102 0.90 MEN1 (0.54) MEN1KMT2ARAB9AKDM4ELMNA
SCHEMBL11213739 0.85 CSNK2A1 (0.60) MEN1KMT2ARAB9AKDM4ELMNA
SCHEMBL11074148 0.84 HPGD (0.61) MEN1KMT2ARAB9AKDM4ELMNA
SCHEMBL10786547 0.84 CSNK2A1 (0.58) MEN1KMT2ARAB9AKDM4ELMNA
SCHEMBL11581510 0.82 KMT2A (0.72) MEN1KMT2ARAB9AKDM4ELMNA
SCHEMBL25035384 0.81 CHRNA7 (0.57) HTT
SCHEMBL8712689 0.81 CSNK2A1 (0.55) MEN1KMT2ARAB9AKDM4ELMNA
SCHEMBL1305878 0.79 CSNK2A1 (0.62) MEN1KMT2ARAB9AKDM4ELMNA
SCHEMBL29368656 0.79 CSNK2A1 (0.62) MEN1KMT2ARAB9AKDM4ELMNA
Ethylene SCHEMBL11475437 0.79 HPGD (0.56) MEN1KMT2ARAB9AKDM4ELMNA

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
US-6689788-B1 USING THIAZOLE OR PYROLE DERIVATIVES UNIVERSITY OF FLORIDA 2004-02-10 US disclosed
US-20030211978-A1 Method and composition for treatment of inflammatory bowel disease BERGERON RAYMOND J (US) 2003-11-13 US disclosed
EP-1113789-A1 METHOD AND COMPOSITION FOR TREATMENT OF INFLAMMATORY BOWEL DISEASE UNIVERSITY OF FLORIDA (US) 2001-07-11 EP disclosed
US-6159983-A Method and composition for treatment of inflammatory bowel disease UNIVERSITY OF FLORIDA (US) 2000-12-12 US disclosed
WO-2000016765-A9 METHOD AND COMPOSITION FOR TREATMENT OF INFLAMMATORY BOWEL DISEASE UNIV FLORIDA (US) 2000-10-05 WO disclosed
WO-2000016765-A1 METHOD AND COMPOSITION FOR TREATMENT OF INFLAMMATORY BOWEL DISEASE UNIVERSITY OF FLORIDA (US) 2000-03-30 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-20030211978-A1 Method and composition for treatment of inflammatory bowel disease SLC10A2, FABP2, SI MEN1 3930/4885KMT2A 4784/4885RAB9A 3977/4885

“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.