SCHEMBL26453057

SCHEMBL26453057

CCC(C)(C)C(=O)Oc1cc(I)c(I)c(I)c1

nearest known ligand 0.41

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ELANE P08246 9/20 0.41
TPMT P51580 1/20 0.34
RIPK1 Q13546 1/20 0.31
BCHE P06276 2/20 0.31
ITGB3 P05106 1/20 0.30
ITGAV P06756 1/20 0.30
THRA P10827 1/20 0.30
THRB P10828 1/20 0.30
RXRA P19793 1/20 0.30
PPARG P37231 1/20 0.30
MEN1 O00255 1/20 0.30
KMT2A Q03164 1/20 0.30
MTNR1A P48039 1/20 0.30
MTNR1B P49286 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
SCHEMBL26853252 0.85 TPMT (0.41) ELANETPMTITGB3ITGAVTHRA
SCHEMBL26355357 0.81 ESR1 (0.43) ELANETHRATHRBRXRAPPARG
SCHEMBL15043140 0.80 ELANE (0.44) ELANEBCHEMEN1KMT2A
SCHEMBL14747378 0.79 ELANE (0.42) ELANETPMTTHRBMEN1KMT2A
SCHEMBL12736994 0.77 ELANE (0.41) ELANERIPK1
SCHEMBL20100786 0.77 ELANE (0.41) ELANEBCHE
SCHEMBL15908062 0.77 ELANE (0.41) ELANERXRA
SCHEMBL25916181 0.77 ELANE (0.53) ELANEMEN1KMT2A
SCHEMBL17552765 0.77 RIPK1 (0.46) ELANERIPK1
SCHEMBL18591093 0.76 ELANE (0.41) ELANEBCHEMEN1KMT2A

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-20230139009-A1 ACTINIC RAY-SENSITIVE OR RADIATION-SENSITIVE RESIN COMPOSITION, RESIST FILM, PATTERN FORMING METHOD, AND METHOD FOR MANUFACTURING ELECTRONIC DEVICE FUJIFILM CORPORATION (JP) 2023-05-04 US disclosed