SCHEMBL8315409

SCHEMBL8315409

COC(=O)n1cccc1C=O

nearest known ligand 0.47

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
TRIM24 O15164 1/20 0.47
TRIM33 Q9UPN9 1/20 0.47
ALDH1A1 P00352 5/20 0.44
GAA P10253 2/20 0.42
LPO P22079 4/20 0.41
CYP1A2 P05177 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.40
P2RX4 Q99571 2/20 0.40
ATM Q13315 1/20 0.39
BCHE P06276 1/20 0.39
MEN1 O00255 1/20 0.38
KMT2A Q03164 1/20 0.38

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
SCHEMBL8377839 0.82 ALDH1A1 (0.45) TRIM24TRIM33ALDH1A1GAALPO
SCHEMBL1960653 0.81 HSP90AA1 (0.44) TRIM24TRIM33ALDH1A1GAACYP1A2
SCHEMBL21407436 0.79 TRIM24 (0.52) TRIM24TRIM33ALDH1A1GAACYP1A2
SCHEMBL7969238 0.77 TRIM24 (0.40) TRIM24TRIM33ALDH1A1GAACYP1A2
SCHEMBL7958548 0.77 TRIM24 (0.40) TRIM24TRIM33ALDH1A1GAACYP1A2
SCHEMBL22076913 0.76 ATM (0.48) TRIM24TRIM33ALDH1A1GAACYP1A2
SCHEMBL16552204 0.75 TRIM24 (0.38) TRIM24TRIM33ALDH1A1GAALPO
SCHEMBL162288 0.75 LPO (0.44) ALDH1A1LPOL3MBTL1P2RX4ATM
SCHEMBL28885007 0.75 TRIM24 (0.47) TRIM24TRIM33ALDH1A1GAACYP1A2
SCHEMBL10772523 0.74 P2RX4 (0.49) ALDH1A1L3MBTL1SMN1; SMN2P2RX4MEN1

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-0623619-B1 PREPARATION METHOD OF ARENO[e]INDOLS PHARMA MAR S A PHARMAR (ES) 1999-02-03 EP disclosed
US-5631384-A Areno [e]indols, preparation method and application as intermediates in the synthesis of products with antitumoral activity PHARMA-MAR, S.A.-PHARMAR (ES) 1997-05-20 US disclosed
US-5571927-A Areno [E]indols, preparation method and application as intermediates in the synthesis of products with antitumoral activity PHARMA-MAR, S.A.- PHARMAR (ES) 1996-11-05 US disclosed
EP-0623619-A1 NEW ARENO[e]INDOLS, PREPARATION METHOD AND APPLICATION AS INTERMEDIATES IN THE SYNTHESIS OF PRODUCTS WITH ANTITUMORAL ACTIVITY PHARMA-MAR S.A.-PHARMAR (ES) 1994-11-09 EP disclosed