SCHEMBL20000877

SCHEMBL20000877

C=C/C=C1\c2c(C)cccc2C(C)(C)C1(C)C

nearest known ligand 0.32

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
PDK2 Q15119 1/20 0.32
CD44 P16070 1/20 0.31

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
SCHEMBL28349484 0.68 CA1 (0.44) PDK2CD44
SCHEMBL12319822 0.63 PDK2 (0.60) PDK2CD44
SCHEMBL28527151 0.61 HTR2A (0.35) PDK2
SCHEMBL12276528 0.61 PDK2 (0.31) PDK2CD44
SCHEMBL28613659 0.61 HTR7 (0.49) PDK2CD44
SCHEMBL18826691 0.61 CA1 (0.30)
SCHEMBL20878402 0.59 DAO (0.40)
SCHEMBL4021982 0.59 ACHE (0.57) CD44
SCHEMBL20886845 0.58 DAO (0.39) PDK2CD44
SCHEMBL10077289 0.58 CD44 (0.30) CD44

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-20180087010-A1 PRE-RINSING LIQUID, PRE-RINSING TREATMENT METHOD, AND PATTERN FORMING METHOD FUJIFILM CORPORATION (JP) 2018-03-29 US disclosed