SCHEMBL7448361

SCHEMBL7448361

CCCc1ccc(C(CCO)N2Cc3ccccc3C2=O)cc1CCC

nearest known ligand 0.63

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 5/20 0.63
KMT2A Q03164 5/20 0.63
ALOX15 P16050 3/20 0.44
KDM4E B2RXH2 2/20 0.44
MAPT P10636 4/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
TDP1 Q9NUW8 2/20 0.42
ALDH1A1 P00352 1/20 0.42
TSHR P16473 1/20 0.42
XIAP P98170 1/20 0.42
HKDC1 Q2TB90 1/20 0.42
HSD17B10 Q99714 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
TNF P01375 1/20 0.42
TP53 P04637 1/20 0.41
POLB P06746 1/20 0.41
THRB P10828 1/20 0.41

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
SCHEMBL7436433 0.90 MEN1 (0.67) MEN1KMT2AALOX15KDM4EMAPT
SCHEMBL7440983 0.82 TNF (0.61) MEN1KMT2ATNF
SCHEMBL7433768 0.80 MEN1 (0.65) MEN1KMT2AMAPTTNFTP53
SCHEMBL7434580 0.79 MEN1 (0.74) MEN1KMT2AMAPTTNFTP53
SCHEMBL7435468 0.77 MEN1 (0.55) MEN1KMT2AALOX15KDM4EMAPT
SCHEMBL6285246 0.72 TP53 (0.57) MEN1KMT2AMAPTTNFTP53
SCHEMBL4857900 0.72 TP53 (0.57) MEN1KMT2AMAPTTNFTP53
SCHEMBL6288909 0.72 TP53 (0.57) MEN1KMT2AMAPTTNFTP53
SCHEMBL7446266 0.70 TNF (0.65) MEN1KMT2AKDM4EALDH1A1HSD17B10
SCHEMBL7431322 0.70 MEN1 (0.65) MEN1KMT2AMAPTTNFTP53

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5703098-A INHIBITORS OF CYTOKINES INCLUDING TUMOR NECROSIS FACTOR CELGENE CORPORATION (US) 1997-12-30 US claimed
EP-0797437-B1 IMMUNOTHERAPEUTIC IMIDES/AMIDES AND THEIR USE FOR REDUCING LEVELS OF TNFalpha CELGENE CORP (US) 2001-04-18 EP disclosed