SCHEMBL9711560

SCHEMBL9711560

Cc1c(C(=O)C2C(=O)CCNC2=O)cccc1[N+](=O)[O-]

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.51
GLA P06280 1/20 0.43
TDP1 Q9NUW8 1/20 0.43
MEN1 O00255 4/20 0.43
KMT2A Q03164 4/20 0.43
SMN1; SMN2 Q16637 2/20 0.43
NPC1 O15118 3/20 0.42
RAB9A P51151 3/20 0.42
ALDH1A1 P00352 2/20 0.42
USP2 O75604 1/20 0.42
HPGD P15428 1/20 0.41
CYP2C9 P11712 1/20 0.41
DHODH Q02127 1/20 0.41
MAPK1 P28482 1/20 0.41
GAA P10253 1/20 0.41
RXFP1 Q9HBX9 1/20 0.41
LMNA P02545 1/20 0.40
CYP1A2 P05177 1/20 0.40
CYP3A4 P08684 1/20 0.40
CYP2D6 P10635 1/20 0.40

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
SCHEMBL9711486 0.87 ALDH1A1 (0.44) TDP1MEN1KMT2ASMN1; SMN2ALDH1A1
SCHEMBL9711681 0.81 TSHR (0.41) TSHRMEN1KMT2AALDH1A1HPGD
SCHEMBL9711707 0.81 HPD (0.48) TSHRMEN1KMT2ANPC1ALDH1A1
SCHEMBL9711538 0.78 HPD (0.46) MEN1KMT2ASMN1; SMN2NPC1RAB9A
SCHEMBL9711723 0.77 HPD (0.40) MEN1KMT2ANPC1RAB9AALDH1A1
SCHEMBL9711540 0.77 HPD (0.49) TSHRMEN1KMT2ASMN1; SMN2RAB9A
SCHEMBL9711616 0.76 HPD (0.46) TSHRMEN1KMT2ASMN1; SMN2NPC1
SCHEMBL9711534 0.76 ITGB1 (0.38) TDP1MEN1KMT2ANPC1RAB9A
SCHEMBL9711711 0.76 HPD (0.48) RAB9AALDH1A1MAPK1
SCHEMBL9711456 0.76 ALDH1A1 (0.41) TSHRTDP1MEN1KMT2ASMN1; 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
US-5114461-A Herbicides MAY & BAKER LIMITED (GB) 1992-05-19 US disclosed
EP-0278742-A2 Cyclic diones MAY & BAKER LIMITED (GB) 1988-08-17 EP disclosed