SCHEMBL29328565

SCHEMBL29328565

O=CCCCn1ncc2ccccc21

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMO O15229 2/20 0.56
CYP1A2 P05177 1/20 0.54
RECQL P46063 2/20 0.50
P2RX7 Q99572 1/20 0.48
DAO P14920 1/20 0.48
ALDH1A1 P00352 2/20 0.43
POLB P06746 3/20 0.41
HSD17B10 Q99714 2/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
ADRA2A P08913 1/20 0.40
PKM P14618 1/20 0.39
NPC1 O15118 2/20 0.39
RAB9A P51151 2/20 0.39
TSHR P16473 2/20 0.39
SMN1; SMN2 Q16637 2/20 0.39
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
NPSR1 Q6W5P4 1/20 0.38
LMNA P02545 1/20 0.38
GAA P10253 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
SCHEMBL29955181 0.90 KMO (0.59) KMOCYP1A2RECQLP2RX7DAO
SCHEMBL3781001 0.90 KMO (0.59) KMOCYP1A2RECQLP2RX7DAO
SCHEMBL1326630 0.81 CYP1A2 (0.58) KMOCYP1A2RECQLP2RX7DAO
SCHEMBL29328869 0.81 FGFR1 (0.39) KMOCYP1A2RECQLP2RX7DAO
SCHEMBL29796402 0.80 RECQL (0.56) KMOCYP1A2RECQLP2RX7DAO
SCHEMBL319515 0.80 RECQL (0.61) KMOCYP1A2RECQLP2RX7DAO
SCHEMBL5338764 0.78 CYP1A2 (0.58) KMOCYP1A2RECQLP2RX7DAO
SCHEMBL4951648 0.78 KMO (0.61) KMOCYP1A2RECQLP2RX7DAO
SCHEMBL731911 0.78 CYP1A2 (0.58) KMOCYP1A2RECQLP2RX7DAO
SCHEMBL3243999 0.78 CYP1A2 (0.58) KMOCYP1A2RECQLP2RX7DAO

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-4234609-B1 METHODS FOR PURIFICATION, DETECTION AND QUANTIFICATION OF RESIDUAL PEI-BASED TRANSFECTION REAGENTS POLYPLUS TRANSFECTION (FR) 2024-07-17 EP disclosed