SCHEMBL29037474

SCHEMBL29037474

Brc1ccc2c3ccccc3n(Cc3ccccc3)c2c1

nearest known ligand 0.70

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ CYP19A1 P11511 1/20 0.70
▸ P2RX4 Q99571 1/20 0.57
▸ SRC P12931 1/20 0.51
▸ DNM1 Q05193 1/20 0.49
▸ MEN1 O00255 3/20 0.49
▸ KMT2A Q03164 3/20 0.49
▸ SMN1; SMN2 Q16637 2/20 0.49
▸ MAPT P10636 2/20 0.49
▸ NPC1 O15118 1/20 0.49
▸ MAPK1 P28482 1/20 0.49
▸ KDM4E B2RXH2 1/20 0.49
▸ ALDH1A1 P00352 1/20 0.49
▸ HDAC6 Q9UBN7 2/20 0.48
▸ HDAC1 Q13547 1/20 0.48
▸ HDAC10 Q969S8 1/20 0.48
▸ TP53 P04637 1/20 0.47
▸ PTGES O14684 1/20 0.46
▸ TSPO P30536 1/20 0.45

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
SCHEMBL19896424 0.95 CYP19A1 (0.60) CYP19A1P2RX4SRCDNM1MEN1
SCHEMBL2246814 0.90 CYP19A1 (0.70) CYP19A1P2RX4SRCDNM1MEN1
SCHEMBL31222301 0.84 CYP19A1 (0.60) CYP19A1P2RX4SRCDNM1MEN1
SCHEMBL2244878 0.84 CYP19A1 (0.60) CYP19A1P2RX4SRCDNM1MEN1
SCHEMBL28337505 0.84 LMNA (0.51) CYP19A1P2RX4DNM1MEN1KMT2A
SCHEMBL30574436 0.84 CYP19A1 (0.70) CYP19A1P2RX4DNM1MEN1KMT2A
SCHEMBL22385834 0.84 CYP19A1 (0.70) CYP19A1P2RX4DNM1MEN1KMT2A
SCHEMBL151053 0.84 CYP19A1 (1.00) CYP19A1P2RX4SRCMEN1KMT2A
SCHEMBL30007452 0.84 CYP19A1 (1.00) CYP19A1P2RX4SRCMEN1KMT2A
SCHEMBL29093125 0.83 CYP19A1 (0.63) CYP19A1P2RX4SMN1; SMN2MAPTHDAC6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116457338-B Polymer composition, liquid crystal aligning agent, resin film, liquid crystal aligning film, method for producing liquid crystal display element, and liquid crystal display element 日产化学株式会社 2024-09-24 — — CN disclosed
CN-116457338-A Polymer composition, liquid crystal aligning agent, resin film, liquid crystal aligning film, method for producing liquid crystal display element, and liquid crystal display element 日产化学株式会社 2023-07-18 — — CN disclosed
WO-2022107640-A1 POLYMER COMPOSITION, LIQUID CRYSTAL ALIGNING AGENT, RESIN FILM, LIQUID CRYSTAL ALIGNMENT FILM, METHOD FOR PRODUCING LIQUID CRYSTAL DISPLAY ELEMENT, AND LIQUID CRYSTAL DISPLAY ELEMENT 日産化学株式会社 2022-05-27 — — WO disclosed
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