SCHEMBL6933685

SCHEMBL6933685

CC(Cl)C(=O)N1CCN(C(=O)C(C)Cl)CC1

nearest known ligand 0.68

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.68
MEN1 O00255 2/20 0.68
KMT2A Q03164 2/20 0.68
SMN1; SMN2 Q16637 2/20 0.37
PIK3CD O00329 1/20 0.37
POLB P06746 1/20 0.36
HSD17B10 Q99714 1/20 0.35
CYP1A2 P05177 1/20 0.35
TDP1 Q9NUW8 1/20 0.35
NPC1 O15118 1/20 0.34
LMNA P02545 2/20 0.33
MAPT P10636 1/20 0.33
ALOX12 P18054 1/20 0.33
HTT P42858 1/20 0.33
NPSR1 Q6W5P4 1/20 0.33

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
SCHEMBL11846880 1.00
SCHEMBL11184724 0.93 ALDH1A1 (0.61) ALDH1A1MEN1KMT2ASMN1; SMN2LMNA
SCHEMBL12789681 0.91 MEN1 (0.59) ALDH1A1MEN1KMT2APOLBHSD17B10
SCHEMBL11844535 0.90
SCHEMBL11837046 0.90 ALDH1A1 (0.63) ALDH1A1MEN1KMT2AHTT
SCHEMBL226270 0.87 ALDH1A1 (0.61) ALDH1A1MEN1KMT2ASMN1; SMN2NPC1
SCHEMBL11061943 0.87 ALDH1A1 (0.61) ALDH1A1MEN1KMT2ASMN1; SMN2NPC1
SCHEMBL1499020 0.85 ALDH1A1 (0.53) ALDH1A1MEN1KMT2ASMN1; SMN2HTT
SCHEMBL6330365 0.84 ALDH1A1 (0.57) ALDH1A1MEN1KMT2ASMN1; SMN2HSD17B10
SCHEMBL3712422 0.84 ALDH1A1 (0.57) ALDH1A1MEN1KMT2ASMN1; SMN2HSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4392882-A N-N-Bis(haloacyl)-diaza-cycloalkanes for protecting plants from herbicide damage BAYER AKTIENGESELLSCHAFT (DE) 1983-07-12 US claimed
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
US-4392882-A N-N-Bis(haloacyl)-diaza-cycloalkanes for protecting plants from herbicide damage BAYER AKTIENGESELLSCHAFT (DE) 1983-07-12 US disclosed
EP-0023305-B1 USE OF N,N'-BIS(HALOGEN-ACYL)-DIAZA-CYCLOALKANES FOR THE PROTECTION OF CULTIVATED PLANTS AGAINST DAMAGE BY HERBICIDES BAYER AG (DE) 1983-03-02 EP disclosed
EP-0023305-A1 Use of N,N'-bis(halogen-acyl)-diaza-cycloalkanes for the protection of cultivated plants against damage by herbicides BAYER AG (DE) 1981-02-04 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 ALDH1A1 597/4885MEN1 1157/4885KMT2A 1009/4885
US-20030199560-A1 Bisaryl compound and medicament for cancer treatment comprising the same AR, NR5A1, SRD5A1 ALDH1A1 597/4885MEN1 1157/4885KMT2A 1009/4885

“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.