SCHEMBL29134375

SCHEMBL29134375

COc1cc(Br)ccc1C1(N)COC1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.37
TDP1 Q9NUW8 1/20 0.37
ALDH1A1 P00352 3/20 0.35
TUBB4A P04350 1/20 0.35
TUBB P07437 1/20 0.35
TUBA3C P0DPH7 1/20 0.35
TUBA1B P68363 1/20 0.35
TUBA4A P68366 1/20 0.35
TUBB4B P68371 1/20 0.35
TUBB3 Q13509 1/20 0.35
TUBB2A Q13885 1/20 0.35
TUBB8 Q3ZCM7 1/20 0.35
TUBA3E Q6PEY2 1/20 0.35
TUBA1A Q71U36 1/20 0.35
TUBA1C Q9BQE3 1/20 0.35
TUBB6 Q9BUF5 1/20 0.35
TUBB2B Q9BVA1 1/20 0.35
TUBB1 Q9H4B7 1/20 0.35
RAB9A P51151 2/20 0.34
MEN1 O00255 2/20 0.34

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
SCHEMBL30956756 0.81 PRKAB2 (0.43) KDM4ETDP1ALDH1A1RAB9AMEN1
SCHEMBL30014820 0.81 KDM4E (0.37) KDM4ETDP1ALDH1A1RAB9AMEN1
SCHEMBL15300869 0.81 PRKAB2 (0.43) KDM4ETDP1ALDH1A1RAB9AMEN1
SCHEMBL29134369 0.78 POLB (0.36) ALDH1A1MEN1KMT2AMAPTBACE1
Hydrochloric Acid SCHEMBL29134800 0.77 POLB (0.35) ALDH1A1MEN1KMT2AMAPTBACE1
SCHEMBL24698740 0.75 KDM1A (0.39) ALDH1A1BACE1
SCHEMBL30016263 0.75 KDM1A (0.39) ALDH1A1BACE1
SCHEMBL29134879 0.74 SMN1; SMN2 (0.38) KDM4EALDH1A1TSHRBACE1POLB
SCHEMBL29134496 0.74 MEN1 (0.33) KDM4ETDP1ALDH1A1RAB9AMEN1
Hydrochloric Acid SCHEMBL29134486 0.73 KDM1A (0.38) ALDH1A1BACE1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4681774-A2 KHK INHIBITORS Gilead Sciences, Inc. (US) 2026-01-21 EP disclosed
EP-4313967-B1 KHK INHIBITORS GILEAD SCIENCES INC (US) 2025-11-12 EP disclosed
EP-4313967-A1 KHK INHIBITORS GILEAD SCIENCES, INC. (US) 2024-02-07 EP disclosed
CN-117120429-A KHK inhibitor 吉利德科学公司 2023-11-24 CN disclosed
WO-2022212194-A1 KHK INHIBITORS GILEAD SCIENCES, INC. (US) 2022-10-06 WO disclosed