SCHEMBL9666178

SCHEMBL9666178

c1ccc(SCC2CC[N]CC2)nc1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CRBN Q96SW2 1/20 0.49
ALDH1A1 P00352 5/20 0.43
KMT2A Q03164 4/20 0.43
EHMT2 Q96KQ7 1/20 0.42
EHMT1 Q9H9B1 1/20 0.42
APOBEC3G Q9HC16 1/20 0.42
NPC1 O15118 4/20 0.41
RAB9A P51151 4/20 0.41
TDP1 Q9NUW8 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
POLB P06746 2/20 0.40
MAPT P10636 2/20 0.39
MEN1 O00255 2/20 0.39
PKM P14618 1/20 0.39
LMNA P02545 1/20 0.38
HPGD P15428 3/20 0.37
HSD17B10 Q99714 2/20 0.37
TSHR P16473 1/20 0.37
KDM4E B2RXH2 1/20 0.37
ALOX15 P16050 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
SCHEMBL9023817 0.90 CRBN (0.47) CRBNALDH1A1KMT2AEHMT2EHMT1
SCHEMBL797147 0.90 CRBN (0.54) CRBNALDH1A1KMT2AEHMT2EHMT1
SCHEMBL9665181 0.83 CRBN (0.48) CRBNALDH1A1KMT2AEHMT2EHMT1
SCHEMBL9663523 0.81 CRBN (0.45) CRBNALDH1A1KMT2AEHMT2EHMT1
Hydrochloric Acid SCHEMBL4465656 0.81 CRBN (0.50) CRBNALDH1A1KMT2AEHMT2EHMT1
SCHEMBL5545416 0.76 CRBN (0.46) CRBNALDH1A1KMT2AEHMT2EHMT1
SCHEMBL9665143 0.75 CRBN (0.41) CRBNALDH1A1KMT2ANPC1RAB9A
SCHEMBL4475396 0.75 POLB (0.54) CRBNALDH1A1KMT2ANPC1RAB9A
SCHEMBL4675111 0.74 EHMT2 (0.47) CRBNALDH1A1KMT2AEHMT2EHMT1
SCHEMBL27550957 0.73 CRBN (0.43) CRBNALDH1A1KMT2APOLBLMNA

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-0500835-A1 A NOVEL QUINOLONE CARBOXYLIC ACID DERIVATIVE. DAE WOONG PHARMA (KR) 1992-09-02 EP disclosed
WO-1992004342-A1 A NOVEL QUINOLONE CARBOXYLIC ACID DERIVATIVE DAEWOONG PHARMACEUTICAL CO., LTD. (KR) 1992-03-19 WO disclosed