Sugi Predict

Sugi Predict / Compounds / SCHEMBL21119639

SCHEMBL21119639

SCHEMBL21119639

c1ccc(-c2ccc3ccc4ccc(-c5ccc(-c6nc7ccc8c9ccccc9sc8c7c7ccccc67)c6ccccc56)nc4c3n2)cc1

nearest known ligand 0.32

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ LIMK1 P53667 1/20 0.32
▸ KDM4E B2RXH2 1/20 0.32
▸ ALDH1A1 P00352 1/20 0.32
▸ MAPT P10636 1/20 0.32
▸ HPGD P15428 1/20 0.32
▸ PARP1 P09874 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
SCHEMBL21119640 0.97 ALOX5 (0.33) LIMK1KDM4EALDH1A1MAPTHPGD
SCHEMBL21119819 0.95 KDM4E (0.34) KDM4EALDH1A1MAPTHPGD
SCHEMBL21537427 0.90 LIMK1 (0.33) LIMK1KDM4EPARP1
SCHEMBL21119956 0.90 LIMK1 (0.34) LIMK1KDM4EALDH1A1MAPTHPGD
SCHEMBL21119972 0.88 LMNA (0.36) KDM4EALDH1A1MAPT
SCHEMBL21119908 0.87 LIMK1 (0.32) LIMK1KDM4EALDH1A1MAPTHPGD
SCHEMBL21119695 0.86 KDM4E (0.33) KDM4EALDH1A1MAPTHPGDPARP1
SCHEMBL21120232 0.85 LMNA (0.36) KDM4EALDH1A1MAPT
SCHEMBL21119692 0.85 LIMK1 (0.36) LIMK1KDM4EALDH1A1MAPTHPGD
SCHEMBL21119607 0.84 LIMK1 (0.34) LIMK1MAPTPARP1

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-11522139-B2 Organic light emitting diode LG DISPLAY CO., LTD. (KR) 2022-12-06 — — US disclosed
US-20190207123-A1 ORGANIC LIGHT EMITTING DIODE LG CHEM, LTD. (KR) 2019-07-04 — — US disclosed