SCHEMBL6931377

SCHEMBL6931377

CC(Cl)C(=O)N(CCCl)CCCl

nearest known ligand 0.39

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
MAPT P10636 1/20 0.32
LMNA P02545 1/20 0.31
TP53 P04637 1/20 0.31
TSHR P16473 1/20 0.31
HTT P42858 1/20 0.31
HBB P68871 1/20 0.31
EGFR P00533 1/20 0.30
ERBB2 P04626 1/20 0.30

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
SCHEMBL4485645 0.81 CA12 (0.32) MAPT
SCHEMBL2921860 0.75 LMNA (0.39) MEN1KMT2ALMNAHTT
SCHEMBL10671732 0.75 LMNA (0.39) MEN1KMT2ALMNAHTT
SCHEMBL10673924 0.75 LMNA (0.39) MEN1KMT2ALMNAHTT
Diethanolamine SCHEMBL5569921 0.71
SCHEMBL7960405 0.69 MAPT (0.38) MEN1KMT2AMAPTLMNATP53
SCHEMBL10828032 0.68 CA12 (0.45) MEN1KMT2AMAPTLMNATSHR
SCHEMBL11160258 0.67
SCHEMBL995987 0.66 TSHR (0.37) MEN1KMT2AMAPTLMNATP53
SCHEMBL571432 0.66 TSHR (0.35) MEN1KMT2AMAPTLMNATP53

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
US-20030199560-A1 Bisaryl compound and medicament for cancer treatment comprising the same KYOWA HAKKO KOGYO CO., LTD. 2003-10-23 US disclosed
US-6608061-B2 Antiproliferative agents KYOMA HAKKO KOGYO CO., LTD. (JP) 2003-08-19 US disclosed
US-20030018070-A1 BISARYL COMPOUND AND MEDICAMENT FOR CANCER TREATMENT COMPRISING THE SAME FUJIFILM CORPORATION (JP) 2003-01-23 US disclosed
EP-0990439-A1 BISARYL COMPOUNDS AND CANCER REMEDIES CONTAINING THE SAME KYOWA HAKKO KOGYO CO., LTD. (JP) 2000-04-05 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 (2 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-20030018070-A1 BISARYL COMPOUND AND MEDICAMENT FOR CANCER TREATMENT COMPRISING THE SAME AR, NR5A1, SRD5A1 MEN1 1157/4885KMT2A 1009/4885MAPT 4649/4885
US-20030199560-A1 Bisaryl compound and medicament for cancer treatment comprising the same AR, NR5A1, SRD5A1 MEN1 1157/4885KMT2A 1009/4885MAPT 4649/4885

“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.