SCHEMBL9847205

SCHEMBL9847205

CCCCCOc1cccc2oc(C(=O)O)cc(=O)c12

nearest known ligand 0.66

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GPR35 Q9HC97 3/20 0.66
TDP1 Q9NUW8 2/20 0.66
LMNA P02545 2/20 0.66
MEN1 O00255 3/20 0.51
KMT2A Q03164 3/20 0.51
HIF1A Q16665 1/20 0.51
ABCG2 Q9UNQ0 3/20 0.49
ABCB1 P08183 2/20 0.46
KDM4E B2RXH2 1/20 0.46
USP2 O75604 1/20 0.46
CSNK2A2 P19784 1/20 0.46
PTGS1 P23219 1/20 0.46
CSNK2B P67870 1/20 0.46
CSNK2A1 P68400 1/20 0.46
CSNK2A3 Q8NEV1 1/20 0.46
NR1I2 O75469 1/20 0.45
CHRM2 P08172 1/20 0.45
CYP3A4 P08684 1/20 0.45
ADRA2A P08913 1/20 0.45
MAPT P10636 1/20 0.45

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
SCHEMBL9847173 0.99 GPR35 (0.65) GPR35TDP1LMNAMEN1KMT2A
SCHEMBL9847108 0.99 GPR35 (0.65) GPR35TDP1LMNAMEN1KMT2A
SCHEMBL9847132 0.96 GPR35 (0.67) GPR35TDP1LMNAMEN1KMT2A
SCHEMBL11248651 0.94 GPR35 (0.74) GPR35TDP1LMNAMEN1KMT2A
SCHEMBL9847114 0.92 GPR35 (0.69) GPR35TDP1LMNAMEN1KMT2A
SCHEMBL11247900 0.92 GPR35 (0.72) GPR35TDP1LMNAMEN1KMT2A
SCHEMBL11246892 0.92 GPR35 (0.72) GPR35TDP1LMNAMEN1KMT2A
SCHEMBL11245442 0.92 GPR35 (0.72) GPR35TDP1LMNAMEN1KMT2A
SCHEMBL11253078 0.92 GPR35 (0.72) GPR35TDP1LMNAMEN1KMT2A
SCHEMBL11250063 0.92 GPR35 (0.72) GPR35TDP1LMNAMEN1KMT2A

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
EP-0413583-A2 Clear, stable cromolyn formulation DEY LABORATORIES; INC. (US) 1991-02-20 EP claimed
EP-0413583-A2 Clear, stable cromolyn formulation DEY LABORATORIES; INC. (US) 1991-02-20 EP disclosed