SCHEMBL29623145

SCHEMBL29623145

O=c1c2cc(Cl)ccc2nc(Nc2ccccc2)n1-c1cccnc1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.48
ALOX12 P18054 1/20 0.48
MAT2A P31153 5/20 0.47
TUBB4A P04350 1/20 0.45
TUBB P07437 1/20 0.45
TUBA3C P0DPH7 1/20 0.45
TUBA1B P68363 1/20 0.45
TUBA4A P68366 1/20 0.45
TUBB4B P68371 1/20 0.45
TUBB3 Q13509 1/20 0.45
TUBB2A Q13885 1/20 0.45
TUBB8 Q3ZCM7 1/20 0.45
TUBA3E Q6PEY2 1/20 0.45
TUBA1A Q71U36 1/20 0.45
TUBA1C Q9BQE3 1/20 0.45
TUBB6 Q9BUF5 1/20 0.45
TUBB2B Q9BVA1 1/20 0.45
TUBB1 Q9H4B7 1/20 0.45
PRMT5 O14744 2/20 0.44
MDM2 Q00987 1/20 0.44

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
SCHEMBL24089900 1.00 ALDH1A1 (0.48) ALDH1A1ALOX12MAT2ATUBB4ATUBB
SCHEMBL23065259 0.96 ALDH1A1 (0.48) ALDH1A1ALOX12MAT2ATUBB4ATUBB
SCHEMBL23958278 0.93 TUBB4A (0.45) ALDH1A1ALOX12MAT2ATUBB4ATUBB
SCHEMBL30025728 0.93 TUBB4A (0.45) ALDH1A1ALOX12MAT2ATUBB4ATUBB
SCHEMBL24089978 0.90 TUBB4A (0.48) TUBB4ATUBBTUBA3CTUBA1BTUBA4A
SCHEMBL24090014 0.89 MAT2A (0.44) ALDH1A1ALOX12MAT2APRMT5CYP3A4
SCHEMBL23065083 0.89 ALDH1A1 (0.43) ALDH1A1ALOX12MAT2ATUBB4ATUBB
SCHEMBL23065227 0.89 TUBB4A (0.44) TUBB4ATUBBTUBA3CTUBA1BTUBA4A
SCHEMBL23958280 0.87 TUBB4A (0.47) TUBB4ATUBBTUBA3CTUBA1BTUBA4A
SCHEMBL23065214 0.87 TUBB4A (0.47) ALDH1A1MAT2ATUBB4ATUBBTUBA3C

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
CN-114650986-A 2-aminoquinazolinone derivatives 住友制药株式会社 2022-06-21 CN claimed
CN-114650986-A 2-aminoquinazolinone derivatives 住友制药株式会社 2022-06-21 CN disclosed