SCHEMBL20100074

SCHEMBL20100074

CNc1c(OC)c(C=O)c(C)c(OC)c1OC

nearest known ligand 0.31

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
IMPDH2 P12268 1/20 0.30

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
SCHEMBL3677774 0.79 AKR1B1 (0.38) IMPDH2
SCHEMBL9021987 0.79 CYP19A1 (0.36) IMPDH2
SCHEMBL25342040 0.79 IGF1R (0.36) IMPDH2
SCHEMBL27932362 0.78
SCHEMBL1637371 0.74 IMPDH2 (0.37) IMPDH2
SCHEMBL25341714 0.72 CYP19A1 (0.37) IMPDH2
SCHEMBL4943759 0.69 IMPDH2 (0.42) IMPDH2
SCHEMBL14392685 0.68 AKR1B1 (0.34) IMPDH2
SCHEMBL25627602 0.68
SCHEMBL10591154 0.67 AKR1B1 (0.33) IMPDH2

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
EP-2868658-B1 Method of preparation of stereospecific quinone derivatives MEHTA DILIP (US) 2018-05-02 EP disclosed