Sugi Predict

Sugi Predict / Compounds / SCHEMBL22919955

SCHEMBL22919955

SCHEMBL22919955

CC1C=c2c(sc3cccc(-c4ccccc4)c23)=CC1

nearest known ligand 0.36

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ LIMK1 P53667 1/20 0.36
▸ F9 P00740 1/20 0.31
▸ PDCD1 Q15116 1/20 0.30
▸ CD274 Q9NZQ7 1/20 0.30
▸ HTR1A P08908 2/20 0.30
▸ HTR7 P34969 2/20 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
SCHEMBL12131130 0.76 GPR3 (0.38) —
SCHEMBL22919954 0.76 LIMK1 (0.40) LIMK1F9
SCHEMBL23893285 0.69 LIMK1 (0.34) LIMK1F9
SCHEMBL18470263 0.66 LIMK1 (0.57) LIMK1F9PDCD1CD274
SCHEMBL21703817 0.65 GPR3 (0.39) —
SCHEMBL26254187 0.65 LIMK1 (0.42) LIMK1F9PDCD1CD274
SCHEMBL19841720 0.64 LIMK1 (0.48) LIMK1F9PDCD1CD274
SCHEMBL26496193 0.64 LIMK1 (0.41) LIMK1F9
SCHEMBL2474182 0.63 GPR3 (0.50) LIMK1F9PDCD1CD274
SCHEMBL30021871 0.63 GPR3 (0.50) LIMK1F9PDCD1CD274

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-3770166-B1 ORGANOMETALLIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME SAMSUNG ELECTRONICS CO LTD (KR) 2021-10-06 — — EP disclosed
EP-3770166-A1 ORGANOMETALLIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME Samsung Electronics Co., Ltd. (KR) 2021-01-27 — — EP disclosed