SCHEMBL27408729

SCHEMBL27408729

N=Cc1ccc(CCO)cc1NCc1ccccc1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TDP1 Q9NUW8 1/20 0.42
▸ KDM4E B2RXH2 4/20 0.39
▸ HSD17B10 Q99714 3/20 0.39
▸ HPGD P15428 2/20 0.39
▸ TSHR P16473 1/20 0.39
▸ PTPN1 P18031 1/20 0.38
▸ PTPN11 Q06124 1/20 0.38
▸ IDO1 P14902 1/20 0.38
▸ MAPT P10636 3/20 0.38
▸ ALDH1A1 P00352 3/20 0.38
▸ GAA P10253 2/20 0.38
▸ ALOX5 P09917 1/20 0.38
▸ BACE1 P56817 1/20 0.38
▸ CYP4F2 P78329 1/20 0.37
▸ CYP4A11 Q02928 1/20 0.37
▸ STAT6 P42226 1/20 0.37
▸ MEN1 O00255 2/20 0.37
▸ ALOX12 P18054 2/20 0.37
▸ KMT2A Q03164 2/20 0.37
▸ POLB P06746 2/20 0.37

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
SCHEMBL19382047 0.82 HDAC8 (0.41) KDM4EHSD17B10HPGDTSHRPTPN1
SCHEMBL18930487 0.78 SMN1; SMN2 (0.50) KDM4EHSD17B10HPGDTSHRPTPN1
SCHEMBL20801152 0.77 HSD17B10 (0.42) TDP1KDM4EHSD17B10HPGDTSHR
SCHEMBL18930965 0.76 HSD17B10 (0.53) TDP1KDM4EHSD17B10HPGDTSHR
SCHEMBL18930822 0.75 HSD17B10 (0.40) KDM4EHSD17B10HPGDTSHRPTPN1
SCHEMBL14392043 0.75 HSD17B10 (0.45) KDM4EHSD17B10HPGDTSHRPTPN1
SCHEMBL19382082 0.72 IDO1 (0.47) KDM4EHSD17B10HPGDTSHRIDO1
SCHEMBL14000510 0.70 ALDH1A1 (0.64) HSD17B10HPGDALDH1A1KMT2APOLB
SCHEMBL14684575 0.70 KDM4E (0.49) KDM4EHSD17B10HPGDMAPTALDH1A1
SCHEMBL3159306 0.68 HSD17B10 (0.52) TDP1KDM4EHSD17B10HPGDTSHR

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
WO-2024076891-A1 POLO LIKE KINASE 4 INHIBITORS ORIC PHARMACEUTICALS, INC. (US) 2024-04-11 — — WO disclosed
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