SCHEMBL29217294

SCHEMBL29217294

O=C(O)C=Cc1c(-c2ccccc2)[nH]c2cc(F)ccc12

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TDO2 P48775 1/20 0.56
▸ TUBB4A P04350 3/20 0.49
▸ TUBB P07437 3/20 0.49
▸ TUBA3C P0DPH7 3/20 0.49
▸ TUBA1B P68363 3/20 0.49
▸ TUBA4A P68366 3/20 0.49
▸ TUBB4B P68371 3/20 0.49
▸ TUBB3 Q13509 3/20 0.49
▸ TUBB2A Q13885 3/20 0.49
▸ TUBB8 Q3ZCM7 3/20 0.49
▸ TUBA3E Q6PEY2 3/20 0.49
▸ TUBA1A Q71U36 3/20 0.49
▸ TUBA1C Q9BQE3 3/20 0.49
▸ TUBB6 Q9BUF5 3/20 0.49
▸ TUBB2B Q9BVA1 3/20 0.49
▸ TUBB1 Q9H4B7 3/20 0.49
▸ LMNA P02545 1/20 0.47
▸ HPGD P15428 1/20 0.47
▸ MEN1 O00255 1/20 0.47
▸ KMT2A Q03164 1/20 0.47

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
SCHEMBL22118422 1.00 TDO2 (0.56) TDO2TUBB4ATUBBTUBA3CTUBA1B
SCHEMBL22118353 0.86 MEN1 (0.52) TDO2TUBB4ATUBBTUBA3CTUBA1B
SCHEMBL29033517 0.84 MEN1 (0.63) LMNAHPGDMEN1KMT2A
SCHEMBL22747625 0.84 TUBB4A (0.47) TUBB4ATUBBTUBA3CTUBA1BTUBA4A
SCHEMBL22118314 0.73 APOL1 (0.52) —
SCHEMBL22118368 0.73 MEN1 (0.49) TDO2LMNAMEN1KMT2APADI4
SCHEMBL22161378 0.72 TUBB4A (0.49) TUBB4ATUBBTUBA3CTUBA1BTUBA4A
SCHEMBL19178919 0.72 TDO2 (1.00) TDO2TUBB4ATUBBTUBA3CTUBA1B
SCHEMBL16789343 0.71 MEN1 (0.50) LMNAHPGDMEN1KMT2APTGS2
SCHEMBL22160189 0.71 GPR17 (0.57) 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
CN-113453760-B APOL1 inhibitors and methods of use thereof 弗特克斯药品有限公司 2024-05-24 — — CN disclosed
CN-113453760-A APOL1 inhibitors and methods of use thereof 弗特克斯药品有限公司 2021-09-28 — — CN disclosed
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