SCHEMBL24465254

SCHEMBL24465254

CN(C)/C=C1/C(=O)CCCCC1O

nearest known ligand 0.37

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
TP53 P04637 1/20 0.37
POLB P06746 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
CTDSP1 Q9GZU7 1/20 0.37
TDP1 Q9NUW8 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
LMNA P02545 1/20 0.36
MAPT P10636 1/20 0.36
CYP2C9 P11712 1/20 0.36
ALOX15 P16050 1/20 0.36
CYP2C19 P33261 1/20 0.36
HTT P42858 1/20 0.36
CREBBP Q92793 1/20 0.36
HSD17B10 Q99714 1/20 0.36
CA1 P00915 1/20 0.31
CA2 P00918 1/20 0.31
CA4 P22748 1/20 0.31
KMT2A Q03164 1/20 0.31

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
SCHEMBL21014711 0.95 TP53 (0.34) TP53POLBSMN1; SMN2CTDSP1TDP1
SCHEMBL24312359 0.87 POLL (0.33) LMNAMAPTCYP2C9ALOX15CYP2C19
SCHEMBL26617703 0.74 CA1 (0.38) TP53POLBSMN1; SMN2CTDSP1TDP1
SCHEMBL26617698 0.74 CA1 (0.38) TP53POLBSMN1; SMN2CTDSP1TDP1
SCHEMBL27244359 0.69 MAP1LC3B (0.33) LMNAMAPTCYP2C9ALOX15CYP2C19
SCHEMBL21134123 0.69 MAP1LC3B (0.33) LMNAMAPTCYP2C9ALOX15CYP2C19
SCHEMBL27244319 0.69 MAP1LC3B (0.33) LMNAMAPTCYP2C9ALOX15CYP2C19
SCHEMBL27244325 0.69 MAP1LC3B (0.33) LMNAMAPTCYP2C9ALOX15CYP2C19
SCHEMBL1617387 0.69 MAPT (0.35) TDP1L3MBTL1LMNAMAPTCYP2C9
SCHEMBL1617390 0.69 MAPT (0.35) TDP1L3MBTL1LMNAMAPTCYP2C9

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
EP-4006036-A1 TETRACYCLIC COMPOUND USED AS CDC7 INHIBITOR CHIA TAI TIANQING PHARMACEUTICAL GROUP CO., LTD. (CN) 2022-06-01 EP disclosed