SCHEMBL7434650

SCHEMBL7434650

O=C1CCN(CC(=O)Nc2cc(F)cc(F)c2)CC1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 7/20 0.54
KDM4E B2RXH2 2/20 0.54
THRB P10828 1/20 0.54
ATM Q13315 2/20 0.50
LMNA P02545 2/20 0.47
POLB P06746 2/20 0.47
TSHR P16473 2/20 0.46
CYP1A2 P05177 1/20 0.46
CYP3A4 P08684 1/20 0.46
CYP2D6 P10635 1/20 0.46
MAPT P10636 1/20 0.46
CYP2C9 P11712 1/20 0.46
CYP2C19 P33261 1/20 0.46
KMT2A Q03164 2/20 0.46
ALOX15 P16050 1/20 0.46
HPGD P15428 1/20 0.46
REV1 Q9UBZ9 1/20 0.46
GLA P06280 1/20 0.46
TDP1 Q9NUW8 1/20 0.46
PKM P14618 1/20 0.46

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
SCHEMBL1441662 0.82 ALDH1A1 (0.54) ALDH1A1KDM4ETHRBATMLMNA
SCHEMBL7438879 0.78 ALDH1A1 (0.71) ALDH1A1KDM4ELMNAPOLBTSHR
SCHEMBL7434820 0.78 ALDH1A1 (0.68) ALDH1A1KDM4ETHRBATMLMNA
SCHEMBL7437444 0.77 KMT2A (0.64) ALDH1A1KDM4ETHRBPOLBTSHR
SCHEMBL7426498 0.77 ME2 (0.58) ALDH1A1KDM4ETHRBATMLMNA
SCHEMBL15587815 0.77 ALDH1A1 (0.62) ALDH1A1KDM4ETHRBATMPOLB
SCHEMBL7440438 0.76 ALDH1A1 (0.54) ALDH1A1KDM4EATMLMNAMAPT
SCHEMBL7441384 0.75 CA1 (0.58) ALDH1A1KDM4ETHRBATMLMNA
SCHEMBL7445611 0.74 POLB (0.59) ALDH1A1LMNAPOLBTSHRCYP1A2
SCHEMBL7445763 0.74 LMNA (0.69) ALDH1A1KDM4ELMNAPOLBTSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4499100-A CARDIOUVASCULAR DISORDERS SYNTEX (U.S.A.) INC. (US) 1985-02-12 US disclosed