SCHEMBL27508376

SCHEMBL27508376

CC(Cn1ccnc1C(O)c1cccc(Cl)c1)C(=O)O

nearest known ligand 0.49

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.45
CYP2D6 P10635 2/20 0.42
CYP2C19 P33261 2/20 0.42
CYP1A2 P05177 1/20 0.42
LMNA P02545 1/20 0.42
KDM4E B2RXH2 1/20 0.41
APAF1 O14727 1/20 0.40
KMO O15229 1/20 0.40
MAPT P10636 1/20 0.39
TDP1 Q9NUW8 1/20 0.38
TSHR P16473 1/20 0.38
HIF1A Q16665 1/20 0.38
MEN1 O00255 1/20 0.38
P2RX3 P56373 1/20 0.38

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
SCHEMBL27699242 0.87 KDM4E (0.55) KMT2ACYP2D6CYP2C19CYP1A2LMNA
SCHEMBL4907876 0.81 SMN1; SMN2 (0.52) KMT2ACYP2D6CYP2C19CYP1A2LMNA
SCHEMBL4906781 0.80 SMN1; SMN2 (0.44) KMT2ACYP2D6CYP2C19CYP1A2LMNA
SCHEMBL27685335 0.78 KMT2A (0.46) KMT2ACYP2D6CYP2C19CYP1A2LMNA
SCHEMBL27508375 0.77 KDM4E (0.41) KMT2ACYP2D6CYP2C19CYP1A2KDM4E
SCHEMBL4908330 0.75 KDM4E (0.68) KMT2ACYP2D6LMNAKDM4EMAPT
SCHEMBL27548146 0.74 CYP1A2 (0.46) KMT2ACYP2D6CYP2C19CYP1A2LMNA
SCHEMBL1573428 0.71 APAF1 (0.42) KMT2ACYP2D6CYP2C19CYP1A2LMNA
SCHEMBL10795101 0.70 KMT2A (0.55) KMT2ACYP2D6CYP2C19CYP1A2LMNA
SCHEMBL697750 0.68 POLB (0.36) KMT2ACYP2D6CYP2C19CYP1A2MAPT

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
CN-1151789-C Utilization of aryl (or heteroaryl) azolylcarbinol derivatives in prepn. of medicament for treating troubles mediated by excess of substance P ��˹���IJ�ʿʵ���ҹɷ����޹�˾ 2004-06-02 CN claimed