SCHEMBL8316830

SCHEMBL8316830

CCOC(=O)OC1C(C)CCN1C(=O)Cc1ccc(Cl)cc1Cl

nearest known ligand 0.43

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.43
SIGMAR1 Q99720 2/20 0.41
ALDH1A1 P00352 1/20 0.41
TSHR P16473 1/20 0.40
ERCC1 P07992 1/20 0.40
ERCC4 Q92889 1/20 0.40
CCR3 P51677 1/20 0.39
CCR5 P51681 1/20 0.39
P2RX7 Q99572 2/20 0.39
PDE3B Q13370 1/20 0.39
PDE3A Q14432 1/20 0.39
MEN1 O00255 1/20 0.38
LMNA P02545 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
EPHX2 P34913 1/20 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
SCHEMBL8317467 0.94 ALDH1A1 (0.46) KMT2ASIGMAR1ALDH1A1TSHRERCC1
SCHEMBL8316844 0.86 KMT2A (0.37) KMT2AALDH1A1TSHRMEN1SMN1; SMN2
SCHEMBL8317694 0.84 KMT2A (0.43) KMT2ASIGMAR1ALDH1A1TSHRERCC1
SCHEMBL8877609 0.83 KMT2A (0.44) KMT2ASIGMAR1ALDH1A1TSHRERCC1
SCHEMBL8314698 0.83 SMN1; SMN2 (0.35) KMT2ATSHRP2RX7MEN1SMN1; SMN2
SCHEMBL9538321 0.82 SIGMAR1 (0.49) KMT2ASIGMAR1ALDH1A1TSHRPDE3B
SCHEMBL8316443 0.82 KMT2A (0.48) KMT2ASIGMAR1ALDH1A1TSHRMEN1
SCHEMBL8316358 0.81 KMT2A (0.40) KMT2ASIGMAR1TSHRERCC1ERCC4
SCHEMBL8318856 0.80 KMT2A (0.40) KMT2ASIGMAR1ALDH1A1TSHRERCC1
SCHEMBL8315832 0.80 KMT2A (0.38) KMT2AALDH1A1TSHRMEN1SMN1; SMN2

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
EP-0501129-B1 Substituted bicyclic 3-arylpyrrolidin-2,4-dion derivatives BAYER AG (DE) 1999-07-14 EP disclosed
EP-0501129-A1 Substituted bicyclic 3-arylpyrrolidin-2,4-dion derivatives BAYER AG (DE) 1992-09-02 EP disclosed