SCHEMBL9501858

SCHEMBL9501858

Cc1ccc(NC2C=Cc3nc4cccc(C)c4cc3C2=O)cc1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PDE3B Q13370 2/20 0.40
▸ PDE3A Q14432 2/20 0.40
▸ PDE2A O00408 1/20 0.38
▸ KDM1A O60341 1/20 0.35
▸ MEN1 O00255 5/20 0.34
▸ KMT2A Q03164 5/20 0.34
▸ CYP3A4 P08684 3/20 0.33
▸ POLB P06746 2/20 0.33
▸ CYP1A2 P05177 2/20 0.33
▸ CYP2D6 P10635 2/20 0.33
▸ GAA P10253 1/20 0.33
▸ CYP2C19 P33261 1/20 0.33
▸ NPSR1 Q6W5P4 1/20 0.33
▸ MAPT P10636 3/20 0.33
▸ SMN1; SMN2 Q16637 2/20 0.33
▸ KDM4E B2RXH2 2/20 0.33
▸ NPC1 O15118 1/20 0.33
▸ RAB9A P51151 1/20 0.33
▸ MAPK1 P28482 2/20 0.32
▸ ALDH1A1 P00352 1/20 0.32

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
SCHEMBL7789108 0.77 RAB9A (0.38) PDE3BPDE3APDE2AMEN1KMT2A
SCHEMBL9334583 0.65 NPC1 (0.41) PDE3BPDE3APDE2AMEN1KMT2A
SCHEMBL8039845 0.65 CDK5 (0.39) KMT2AGAANPSR1MAPTSMN1; SMN2
SCHEMBL18493250 0.64 RAB9A (0.35) POLBNPSR1MAPTSMN1; SMN2KDM4E
SCHEMBL11799791 0.63 NPC1 (0.36) PDE3BPDE3APDE2AMEN1KMT2A
SCHEMBL3859298 0.60 NPC1 (0.41) PDE3BPDE3APDE2AMEN1KMT2A
SCHEMBL11055765 0.59 ATM (0.49) PDE3BPDE3AMEN1KMT2APOLB
SCHEMBL16346102 0.58 NPC1 (0.40) PDE3BPDE3APDE2AMEN1KMT2A
SCHEMBL862361 0.58 PDE3B (0.49) PDE3BPDE3APDE2ACYP1A2ALDH1A1
SCHEMBL355569 0.57 BTK (0.39) PDE3BPDE3APDE2AMEN1KMT2A

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
EP-0253276-B1 PIGMENTS OF THE QUINACRIDONEQUINONE GROUP, THEIR PREPARATION PROCESS AND THEIR USE HOECHST AKTIENGESELLSCHAFT (DE) 1993-04-21 — — EP disclosed
US-4881980-A ACRIDONES INCORPORATED IN CRYSTAL LATTICE HOECHST AKTIENGESELLSCHAFT (DE) 1989-11-21 — — US disclosed
EP-0253276-A2 Pigments of the quinacridonequinone group, their preparation process and their use HOECHST AKTIENGESELLSCHAFT (DE) 1988-01-20 — — EP disclosed
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