SCHEMBL28613347

SCHEMBL28613347

CC(C)(C)[Si](C)(C)Oc1ccc(C(=O)O)c(CBr)c1

nearest known ligand 0.43

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CA12 O43570 4/20 0.43
CA1 P00915 4/20 0.43
CA9 Q16790 4/20 0.43
ALDH1A1 P00352 2/20 0.40
PREP P48147 4/20 0.39
KDM4E B2RXH2 2/20 0.38
HPSE Q9Y251 2/20 0.34
LTB4R Q15722 1/20 0.34
LTB4R2 Q9NPC1 1/20 0.34
HSP90AA1 P07900 1/20 0.34
HSP90AB1 P08238 1/20 0.34
AKR1C3 P42330 1/20 0.33
AKR1C2 P52895 1/20 0.33
DRD2 P14416 1/20 0.33
HPGD P15428 1/20 0.33

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
SCHEMBL7308992 0.90 CA12 (0.43) CA12CA1CA9ALDH1A1PREP
SCHEMBL24420805 0.89 CA12 (0.43) CA12CA1CA9ALDH1A1PREP
SCHEMBL20231316 0.86 CA12 (0.41) CA12CA1CA9ALDH1A1PREP
SCHEMBL29614665 0.86 CA12 (0.41) CA12CA1CA9ALDH1A1PREP
SCHEMBL7257494 0.84 HPSE (0.47) CA12CA1CA9HPSE
SCHEMBL4753702 0.81 CA12 (0.46) CA12CA1CA9ALDH1A1PREP
SCHEMBL14786374 0.81 ALDH1A1 (0.42) ALDH1A1KDM4ELTB4RLTB4R2AKR1C3
SCHEMBL29061089 0.80 USP14 (0.35) ALDH1A1DRD2HPGD
SCHEMBL2317055 0.79 AKR1C3 (0.50) ALDH1A1KDM4EAKR1C3AKR1C2HPGD
SCHEMBL1604135 0.78 CA12 (0.43) CA12CA1CA9ALDH1A1PREP

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-116745295-A BRM targeting compounds and related methods of use 普莱鲁德疗法有限公司 2023-09-12 CN disclosed
CN-113164775-A Polycyclic compounds and methods for rapid accelerated targeted degradation of fibrosarcoma polypeptides 阿尔维纳斯运营股份有限公司 2021-07-23 CN disclosed