SCHEMBL9558644

SCHEMBL9558644

Cc1c(C)c2c(c(C)c1O)CCC(C)(CCCCOc1ccc(NC(=N)N)cc1)O2

nearest known ligand 0.49

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CYP4F2 P78329 1/20 0.49
MAPT P10636 3/20 0.48
LMNA P02545 2/20 0.48
MEN1 O00255 2/20 0.48
KMT2A Q03164 2/20 0.48
TTPA P49638 2/20 0.48
GSTP1 P09211 1/20 0.48
USP2 O75604 1/20 0.48
THRB P10828 1/20 0.48
CYP2C9 P11712 1/20 0.48
CYP2C19 P33261 1/20 0.48
NR1I2 O75469 2/20 0.47
TDP1 Q9NUW8 1/20 0.46
ALOX5 P09917 6/20 0.44
PPARG P37231 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
Iodide SCHEMBL9225364 0.99 CYP4F2 (0.49) CYP4F2MAPTLMNAMEN1KMT2A
Hydrochloric Acid SCHEMBL9075304 0.99 CYP4F2 (0.49) CYP4F2MAPTLMNAMEN1KMT2A
Hydrochloric Acid SCHEMBL9076473 0.98 CYP4F2 (0.50) CYP4F2MAPTLMNAMEN1KMT2A
SCHEMBL9074690 0.95 MAPT (0.46) CYP4F2MAPTLMNAMEN1KMT2A
SCHEMBL9559157 0.94 MAPT (0.47) CYP4F2MAPTLMNAMEN1KMT2A
Hydrochloric Acid SCHEMBL9075614 0.94 MAPT (0.46) CYP4F2MAPTLMNAMEN1KMT2A
Iodide SCHEMBL9223622 0.94 MAPT (0.47) CYP4F2MAPTLMNAMEN1KMT2A
Hydrochloric Acid SCHEMBL9075198 0.94 MAPT (0.47) CYP4F2MAPTLMNAMEN1KMT2A
SCHEMBL9075762 0.93 CYP4F2 (0.44) CYP4F2MAPTLMNAMEN1KMT2A
Hydrochloric Acid SCHEMBL9074837 0.93 CYP4F2 (0.44) CYP4F2MAPTLMNAMEN1KMT2A

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-5266709-A Treatment of diabetic complications ONO PHARMACEUTICAL CO., LTD. (JP) 1993-11-30 US claimed
EP-0387771-A2 Benzopyran derivatives ONO PHARMACEUTICAL CO., LTD. (JP) 1990-09-19 EP claimed