SCHEMBL6341007

SCHEMBL6341007

COC(=O)C1=Cc2cc(Br)ccc2N(C(C)C)CC1

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TUBB4A P04350 1/20 0.34
TUBB P07437 1/20 0.34
TUBA3C P0DPH7 1/20 0.34
TUBA1B P68363 1/20 0.34
TUBA4A P68366 1/20 0.34
TUBB4B P68371 1/20 0.34
TUBB3 Q13509 1/20 0.34
TUBB2A Q13885 1/20 0.34
TUBB8 Q3ZCM7 1/20 0.34
TUBA3E Q6PEY2 1/20 0.34
TUBA1A Q71U36 1/20 0.34
TUBA1C Q9BQE3 1/20 0.34
TUBB6 Q9BUF5 1/20 0.34
TUBB2B Q9BVA1 1/20 0.34
TUBB1 Q9H4B7 1/20 0.34
PRKCZ Q05513 1/20 0.34
HSD17B3 P37058 1/20 0.34
ABHD6 Q9BV23 1/20 0.33
NR4A2 P43354 1/20 0.33
TSHR P16473 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
SCHEMBL7544590 0.87 RARA (0.41) SMN1; SMN2LMNASRD5A1SRD5A2CYP1A2
SCHEMBL1808428 0.84 KDM4E (0.38) TUBB4ATUBBTUBA3CTUBA1BTUBA4A
SCHEMBL6341099 0.83 CYP1A2 (0.41) TUBB4ATUBBTUBA3CTUBA1BTUBA4A
SCHEMBL6339987 0.81 KDM4E (0.42) TUBB4ATUBBTUBA3CTUBA1BTUBA4A
SCHEMBL6341939 0.81 CYP1A2 (0.36) TUBB4ATUBBTUBA3CTUBA1BTUBA4A
SCHEMBL6344495 0.81 TUBB4A (0.34) TUBB4ATUBBTUBA3CTUBA1BTUBA4A
SCHEMBL3177372 0.79 CYP2C9 (0.38) TUBB4ATUBBTUBA3CTUBA1BTUBA4A
SCHEMBL3177367 0.79 CYP2C9 (0.38) TUBB4ATUBBTUBA3CTUBA1BTUBA4A
SCHEMBL6341907 0.79 NPC1 (0.42) PRKCZHSD17B3SMN1; SMN2LMNASRD5A1
SCHEMBL6351255 0.79 CUL4A (0.38) TUBB4ATUBBTUBA3CTUBA1BTUBA4A

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
US-6936602-B1 Benzazepine derivatives, process for the preparation of the same and uses thereof TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 2005-08-30 US disclosed
EP-1186604-A1 BENZAZEPINE DERIVATIVES, PROCESS FOR THE PREPARATION OF THE SAME AND USES THEREOF Takeda Chemical Industries, Ltd. (JP) 2002-03-13 EP disclosed