SCHEMBL8873145

SCHEMBL8873145

COc1ccc(-c2nc3ccccn3c2Br)cc1

nearest known ligand 0.70

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 7/20 0.70
NPC1 O15118 6/20 0.70
KDM4E B2RXH2 7/20 0.65
ALDH1A1 P00352 5/20 0.65
SMN1; SMN2 Q16637 3/20 0.65
TUBB4A P04350 3/20 0.64
TUBB P07437 3/20 0.64
TUBA3C P0DPH7 3/20 0.64
TUBA1B P68363 3/20 0.64
TUBA4A P68366 3/20 0.64
TUBB4B P68371 3/20 0.64
TUBB3 Q13509 3/20 0.64
TUBB2A Q13885 3/20 0.64
TUBB8 Q3ZCM7 3/20 0.64
TUBA3E Q6PEY2 3/20 0.64
TUBA1A Q71U36 3/20 0.64
TUBA1C Q9BQE3 3/20 0.64
TUBB6 Q9BUF5 3/20 0.64
TUBB2B Q9BVA1 3/20 0.64
TUBB1 Q9H4B7 3/20 0.64

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
SCHEMBL29833393 0.85 NPC1 (0.51) RAB9ANPC1KDM4EALDH1A1SMN1; SMN2
SCHEMBL22627444 0.84 RAB9A (0.72) RAB9ANPC1KDM4EALDH1A1SMN1; SMN2
SCHEMBL18221717 0.83 NPC1 (0.63) RAB9ANPC1KDM4EALDH1A1SMN1; SMN2
SCHEMBL8873874 0.83 NPC1 (0.71) RAB9ANPC1KDM4EALDH1A1SMN1; SMN2
SCHEMBL973109 0.82 NPC1 (0.64) RAB9ANPC1KDM4EALDH1A1SMN1; SMN2
SCHEMBL8874767 0.82 RAB9A (1.00) RAB9ANPC1KDM4EALDH1A1SMN1; SMN2
SCHEMBL22615062 0.82 RAB9A (0.70) RAB9ANPC1KDM4EALDH1A1SMN1; SMN2
SCHEMBL4726857 0.82 NPC1 (0.70) RAB9ANPC1KDM4EALDH1A1SMN1; SMN2
SCHEMBL13325765 0.81 NPC1 (0.68) RAB9ANPC1KDM4EALDH1A1SMN1; SMN2
SCHEMBL15825411 0.80 ALDH1A1 (0.62) RAB9ANPC1KDM4EALDH1A1MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5658857-A HERBICIDES BAYER AKTIENGESELLSCHAFT (DE) 1997-08-19 US claimed
EP-0683779-A1 IMIDAZOAZINES BAYER AG (DE) 1995-11-29 EP claimed
WO-1994018198-A1 IMIDAZOAZINES BAYER AKTIENGESELLSCHAFT (DE) 1994-08-18 WO claimed
CN-114989167-B 3,6-dibromo or 3-bromoimidazo [1,2-a ] pyridine derivative and synthesis method thereof 江苏师范大学 2023-08-22 CN disclosed
CN-114989167-A 3,6-dibromo or 3-bromo imidazo [1,2-a ] pyridine derivative and synthesis method thereof 江苏师范大学 2022-09-02 CN disclosed
US-5658857-A HERBICIDES BAYER AKTIENGESELLSCHAFT (DE) 1997-08-19 US disclosed
EP-0683779-A1 IMIDAZOAZINES BAYER AG (DE) 1995-11-29 EP disclosed
WO-1994018198-A1 IMIDAZOAZINES BAYER AKTIENGESELLSCHAFT (DE) 1994-08-18 WO disclosed