SCHEMBL31397692

SCHEMBL31397692

Cc1cccc(Sc2c[nH]c3ccccc23)c1

nearest known ligand 0.70

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
IDO1 P14902 6/20 0.70
TUBB4A P04350 4/20 0.68
TUBB P07437 4/20 0.68
TUBA3C P0DPH7 4/20 0.68
TUBA1B P68363 4/20 0.68
TUBA4A P68366 4/20 0.68
TUBB4B P68371 4/20 0.68
TUBB3 Q13509 4/20 0.68
TUBB2A Q13885 4/20 0.68
TUBB8 Q3ZCM7 4/20 0.68
TUBA3E Q6PEY2 4/20 0.68
TUBA1A Q71U36 4/20 0.68
TUBA1C Q9BQE3 4/20 0.68
TUBB6 Q9BUF5 4/20 0.68
TUBB2B Q9BVA1 4/20 0.68
TUBB1 Q9H4B7 4/20 0.68
GFER P55789 1/20 0.50
RHEB Q15382 1/20 0.46
HTR1A P08908 3/20 0.45
HTR3A P46098 2/20 0.45

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
SCHEMBL29988391 0.82 TUBB4A (0.74) IDO1TUBB4ATUBBTUBA3CTUBA1B
SCHEMBL7498794 0.82 TUBB4A (0.74) IDO1TUBB4ATUBBTUBA3CTUBA1B
SCHEMBL4068600 0.81 TUBB4A (1.00) IDO1TUBB4ATUBBTUBA3CTUBA1B
SCHEMBL28195595 0.81 IDO1 (0.79) IDO1TUBB4ATUBBTUBA3CTUBA1B
SCHEMBL34463637 0.80 TUBB4A (0.96) IDO1TUBB4ATUBBTUBA3CTUBA1B
SCHEMBL28069332 0.78 TUBB4A (0.58) IDO1TUBB4ATUBBTUBA3CTUBA1B
SCHEMBL28241888 0.78 TUBB4A (0.67) IDO1TUBB4ATUBBTUBA3CTUBA1B
SCHEMBL5307941 0.77 TUBB4A (0.77) IDO1TUBB4ATUBBTUBA3CTUBA1B
SCHEMBL29286702 0.77 IDO1 (0.53) IDO1TUBB4ATUBBTUBA3CTUBA1B
SCHEMBL28196294 0.76 TUBB4A (0.59) IDO1TUBB4ATUBBTUBA3CTUBA1B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119425756-A Nitrogen-doped carbon-supported bimetallic catalyst as well as preparation method and application thereof 河南科技大学 2025-02-14 CN disclosed