SCHEMBL25360288

SCHEMBL25360288

OB(O)c1cccc2nc(-c3ccccc3)oc12

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ DHODH Q02127 1/20 0.57
▸ ELANE P08246 1/20 0.50
▸ MTNR1A P48039 6/20 0.48
▸ MTNR1B P49286 6/20 0.48
▸ ESR1 P03372 1/20 0.44
▸ ESR2 Q92731 1/20 0.44
▸ NPC1 O15118 4/20 0.44
▸ RAB9A P51151 4/20 0.44
▸ HPGD P15428 3/20 0.43
▸ KDM4E B2RXH2 3/20 0.43
▸ SMN1; SMN2 Q16637 2/20 0.43
▸ POLB P06746 1/20 0.43
▸ CASP3 P42574 1/20 0.43
▸ SENP8 Q96LD8 1/20 0.43
▸ SENP7 Q9BQF6 1/20 0.43
▸ SENP6 Q9GZR1 1/20 0.43
▸ ALDH1A1 P00352 4/20 0.42
▸ KMT2A Q03164 2/20 0.42
▸ F2 P00734 1/20 0.42
▸ HTR3A P46098 1/20 0.41

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
SCHEMBL30594907 1.00 DHODH (0.57) DHODHELANEMTNR1AMTNR1BESR1
SCHEMBL28581161 0.80 ESR1 (0.51) ESR1ESR2NPC1RAB9AHPGD
SCHEMBL14662413 0.80 DHODH (0.47) DHODHELANEMTNR1AMTNR1BESR1
SCHEMBL1040237 0.78 DHODH (0.62) DHODHELANEMTNR1AMTNR1BESR1
SCHEMBL2587399 0.78 DHODH (0.58) DHODHELANEMTNR1AMTNR1BESR1
SCHEMBL30594910 0.77 DHODH (0.54) DHODHELANEMTNR1AMTNR1BESR1
SCHEMBL29819490 0.76 DHODH (0.59) DHODHELANEMTNR1AMTNR1BESR1
SCHEMBL24295099 0.76 DHODH (0.59) DHODHELANEMTNR1AMTNR1BESR1
SCHEMBL5123782 0.75 DHODH (0.59) DHODHELANEMTNR1AMTNR1BESR1
SCHEMBL121400 0.75 DHODH (0.94) DHODHELANEMTNR1AMTNR1BESR1

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2024014934-A1 COMPOSITION FOR ORGANIC OPTOELECTRONIC DIODE, ORGANIC OPTOELECTRONIC DIODE AND DISPLAY DEVICE 삼성에스디아이 주식회사 2024-01-18 — — WO disclosed
CN-112830902-B Heterocyclic spirofluorene compounds and uses thereof 石家庄诚志永华显示材料有限公司 2023-09-29 — — CN disclosed
WO-2023153905-A1 COMPOSITION FOR ORGANIC OPTOELECTRONIC DIODE, ORGANIC OPTOELECTRONIC DIODE, AND DISPLAY DEVICE 삼성에스디아이 주식회사 2023-08-17 — — WO disclosed
CN-112830902-A Heterocyclic spirofluorene compound and application thereof 石家庄诚志永华显示材料有限公司 2021-05-25 — — CN disclosed
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