SCHEMBL533160

SCHEMBL533160

CCCC(=O)N1c2ccc(C(=O)O)cc2[C@H](Oc2ccc(Cl)cc2)C[C@@H]1C

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPSR1 Q6W5P4 3/20 0.46
MAPT P10636 2/20 0.46
LMNA P02545 2/20 0.46
SMN1; SMN2 Q16637 2/20 0.46
MEN1 O00255 1/20 0.46
KMT2A Q03164 1/20 0.46
BRD4 O60885 5/20 0.42
BRD2 P25440 3/20 0.42
BRD3 Q15059 3/20 0.42
CYP3A4 P08684 2/20 0.42
CYP2C9 P11712 2/20 0.42
CYP2C19 P33261 2/20 0.42
TRIM24 O15164 1/20 0.42
TAF1 P21675 1/20 0.42
EP300 Q09472 1/20 0.42
BRDT Q58F21 1/20 0.42
PBRM1 Q86U86 1/20 0.42
TAF1L Q8IZX4 1/20 0.42
CREBBP Q92793 1/20 0.42
BRWD1 Q9NSI6 1/20 0.42

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
SCHEMBL222904 0.90 NPSR1 (0.46) NPSR1MAPTLMNASMN1; SMN2MEN1
SCHEMBL223583 0.87 BRD4 (0.55) SMN1; SMN2BRD4BRD2BRD3CYP3A4
SCHEMBL225509 0.87 BRD4 (0.55) SMN1; SMN2BRD4BRD2BRD3CYP3A4
SCHEMBL225291 0.85 MAPT (0.42) NPSR1MAPTLMNASMN1; SMN2MEN1
SCHEMBL222992 0.80 LMNA (0.59) NPSR1MAPTLMNASMN1; SMN2MEN1
SCHEMBL532665 0.79 MAPT (0.48) NPSR1MAPTLMNASMN1; SMN2MEN1
SCHEMBL225382 0.78 BRD4 (0.45) NPSR1MAPTLMNASMN1; SMN2MEN1
SCHEMBL220928 0.78 BRD4 (0.58) SMN1; SMN2BRD4BRD2BRD3CYP3A4
SCHEMBL222269 0.78 BRD4 (0.58) SMN1; SMN2BRD4BRD2BRD3CYP3A4
SCHEMBL15890804 0.76 BRD4 (0.45) NPSR1MAPTLMNASMN1; SMN2MEN1

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-2415764-A1 PROPHYLACTIC AND/OR THERAPEUTIC AGENT FOR ANEMIA COMPRISING TETRAHYDROQUINOLINE COMPOUND AS ACTIVE INGREDIENT Kowa Company, Ltd. (JP) 2012-02-08 EP disclosed