SCHEMBL4629400

SCHEMBL4629400

CC(C)c1ccccc1NC(=N)NC(=O)c1c(Cl)cccc1Cl

nearest known ligand 0.46

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.45
LPAR1 Q92633 1/20 0.43
ITGB1 P05556 1/20 0.42
ITGA4 P13612 1/20 0.42
CXCL8 P10145 3/20 0.42
LMNA P02545 2/20 0.42
ALDH1A1 P00352 2/20 0.42
AKR1C3 P42330 1/20 0.41
KMT2A Q03164 1/20 0.40
RECQL P46063 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40

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
SCHEMBL4628954 0.81 LMNA (0.55) MAPTLMNAKMT2ARECQLSMN1; SMN2
SCHEMBL4629293 0.78 ALDH1A1 (0.47) MAPTITGB1ITGA4LMNAALDH1A1
SCHEMBL2850718 0.77 MAPT (0.49) MAPTLPAR1ITGB1ITGA4CXCL8
SCHEMBL4628744 0.77 SCN5A (0.53) MAPTLPAR1LMNAALDH1A1KMT2A
SCHEMBL4628708 0.77 ALDH1A1 (0.48) MAPTLMNAALDH1A1AKR1C3KMT2A
SCHEMBL6721277 0.76 GRIN2D (0.53) MAPTLPAR1KMT2ARECQL
SCHEMBL30479702 0.76 GRIN2D (0.53) MAPTLPAR1KMT2ARECQL
SCHEMBL7855179 0.75 MAPT (0.50) MAPTLPAR1ITGB1ITGA4CXCL8
SCHEMBL4628567 0.73 KMT2A (0.53) MAPTLMNAALDH1A1KMT2ASMN1; SMN2
SCHEMBL4627560 0.72 LPAR1 (0.50) MAPTLPAR1LMNAALDH1A1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1918272-A1 Pharmaceutically active compounds and methods of use Wyeth a Corporation of the State of Delaware (US) 2008-05-07 EP disclosed
US-20060270741-A1 Pharmaceutically active compounds and methods of use SCION PHARMACEUTICALS, INC. (US) 2006-11-30 US disclosed
US-7041702-B1 Pharmaceutically active compounds and methods of use SCION PHARMACEUTICALS, INC. (US) 2006-05-09 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-20060270741-A1 Pharmaceutically active compounds and methods of use GBA1, CTSA, GAA MAPT 705/4885LPAR1 991/4885ITGB1 4216/4885

“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.