SCHEMBL27979361

SCHEMBL27979361

C1=CC2=C(c3ccccc3)C3=NC(=C(c4ccccc4)C4=NC(=C(c5ccccc5)C5=NC(=C(c6ccccc6)C1=N2)C=C5)C=C4)C=C3.[Cu]

nearest known ligand 0.35

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 2/20 0.35
▸ RAB9A P51151 3/20 0.33
▸ NPC1 O15118 2/20 0.33
▸ MAPK1 P28482 1/20 0.33
▸ NOTUM Q6P988 1/20 0.32
▸ MEN1 O00255 1/20 0.31
▸ KMT2A Q03164 1/20 0.31
▸ SMN1; SMN2 Q16637 2/20 0.30
▸ KDM4E B2RXH2 1/20 0.30
▸ LMNA P02545 1/20 0.30
▸ GLA P06280 1/20 0.30
▸ HPGD P15428 1/20 0.30
▸ PDE4B Q07343 1/20 0.30
▸ ATM Q13315 1/20 0.30
▸ ALOX15 P16050 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
SCHEMBL7996476 0.95 ALDH1A1 (0.35) ALDH1A1RAB9ANPC1MAPK1NOTUM
SCHEMBL14562749 0.95 ALDH1A1 (0.35) ALDH1A1RAB9ANPC1MAPK1NOTUM
SCHEMBL28807262 0.95 ALDH1A1 (0.35) ALDH1A1RAB9ANPC1MAPK1NOTUM
SCHEMBL2517442 0.95 ALDH1A1 (0.35) ALDH1A1RAB9ANPC1MAPK1NOTUM
SCHEMBL28180007 0.95 ALDH1A1 (0.35) ALDH1A1RAB9ANPC1MAPK1NOTUM
Trimethylammonium SCHEMBL8994460 0.90 GSK3B (0.35) ALDH1A1RAB9ANPC1MAPK1MEN1
SCHEMBL28062944 0.90 ALDH1A1 (0.31) ALDH1A1RAB9ANPC1MAPK1
SCHEMBL27654960 0.88 CYP1A1 (0.34) —
SCHEMBL27838898 0.88 NOTUM (0.52) ALDH1A1RAB9ANPC1MAPK1NOTUM
SCHEMBL14080751 0.88 NOTUM (0.52) ALDH1A1RAB9ANPC1MAPK1NOTUM

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-111848932-A Preparation of porphyrin-based porous polymer and application of porphyrin-based porous polymer in styrene oxidation catalysis 青岛科技大学 2020-10-30 — — CN claimed
CN-111848932-A Preparation of porphyrin-based porous polymer and application of porphyrin-based porous polymer in styrene oxidation catalysis 青岛科技大学 2020-10-30 — — CN disclosed
CN-106366086-B A kind of β-(2,3- dihydro-naphthalene [1,2, e]-m- oxazines) aphthacene base porphyrin compound and its preparation method and application 武汉工程大学 2018-12-14 — — CN disclosed
CN-106366086-A Beta-(2,3-dihydro-naphthyl[1,2,e]-m-oxazinyl) tetraphenylporphyrin, and preparation method and application thereof 武汉工程大学 2017-02-01 — — CN disclosed
CN-104062292-A Method for manufacturing all-solid visualized taste sense sensor array UNIV JIANGSU 2014-09-24 — — CN disclosed
Send feedback