SCHEMBL21753093

SCHEMBL21753093

O=C(O)c1cccc(CCOCc2ccccc2)c1C(=O)O

nearest known ligand 0.61

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
FOLH1 Q04609 7/20 0.51
ALDH1A1 P00352 2/20 0.47
BID P55957 1/20 0.46
BCL2L1 Q07817 1/20 0.46
MCL1 Q07820 1/20 0.46
BAK1 Q16611 1/20 0.46
TSHR P16473 2/20 0.41
PTGER1 P34995 1/20 0.41
KMT2A Q03164 1/20 0.41
PTK2B Q14289 1/20 0.41
HTT P42858 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
HMGB1 P09429 1/20 0.40

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
SCHEMBL30128417 1.00 FOLH1 (0.51) FOLH1ALDH1A1BIDBCL2L1MCL1
SCHEMBL291607 0.89 FOLH1 (0.54) FOLH1ALDH1A1TSHRKMT2APTK2B
SCHEMBL7201890 0.83 FOLH1 (0.47) FOLH1ALDH1A1BIDBCL2L1MCL1
SCHEMBL23043892 0.83 ALDH1A1 (0.47) FOLH1ALDH1A1MCL1TSHRKMT2A
SCHEMBL3001321 0.82 FOLH1 (0.55) FOLH1ALDH1A1BIDBCL2L1MCL1
SCHEMBL3680999 0.80 ALDH1A1 (0.55) FOLH1ALDH1A1TSHRKMT2ASMN1; SMN2
SCHEMBL5682890 0.80 KMT2A (0.45) FOLH1ALDH1A1TSHRKMT2AHTT
SCHEMBL22912 0.80 FOLH1 (0.59) FOLH1ALDH1A1BIDBCL2L1MCL1
SCHEMBL9011107 0.80 FOLH1 (0.49) FOLH1BIDBCL2L1MCL1BAK1
SCHEMBL18038407 0.80 BID (0.65) FOLH1BIDBCL2L1MCL1BAK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4110772-A1 TROPOMYOSIN RECEPTOR KINASE (TRK) DEGRADATION COMPOUNDS AND METHODS OF USE Cullgen (Shanghai), Inc. (CN) 2023-01-04 EP disclosed
EP-3841098-A1 TROPOMYOSIN RECEPTOR KINASE (TRK) DEGRADATION COMPOUNDS AND METHODS OF USE Cullgen (Shanghai), Inc. (CN) 2021-06-30 EP disclosed
CN-112888681-A Tropomyosin Receptor Kinase (TRK) degrading compounds and methods of use 上海睿跃生物科技有限公司 2021-06-01 CN disclosed
WO-2020038415-A1 TROPOMYOSIN RECEPTOR KINASE (TRK) DEGRADATION COMPOUNDS AND METHODS OF USE CULLGEN (SHANGHAI), INC. (CN) 2020-02-27 WO disclosed