SCHEMBL29946404

SCHEMBL29946404

Nc1ccc(O)c(-c2nc3ccccc3[nH]2)c1

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ADORA2A P29274 1/20 0.65
F7 P08709 1/20 0.58
NPC1 O15118 10/20 0.58
RAB9A P51151 10/20 0.58
SMN1; SMN2 Q16637 9/20 0.58
ALDH1A1 P00352 9/20 0.58
HPGD P15428 7/20 0.58
KDM4E B2RXH2 7/20 0.58
HSD17B10 Q99714 6/20 0.58
MAPT P10636 5/20 0.58
TP53 P04637 3/20 0.58
NPSR1 Q6W5P4 3/20 0.58
GAA P10253 3/20 0.58
GFER P55789 2/20 0.58
GLA P06280 2/20 0.58
POLB P06746 2/20 0.58
USP2 O75604 2/20 0.56
TDP1 Q9NUW8 2/20 0.56
EGFR P00533 1/20 0.55
PKM P14618 2/20 0.53

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
SCHEMBL27914039 0.89 ALDH1A1 (0.59) ADORA2AF7NPC1RAB9ASMN1; SMN2
SCHEMBL29769324 0.89 ALDH1A1 (0.59) ADORA2AF7NPC1RAB9ASMN1; SMN2
SCHEMBL20485591 0.89 AMY1A (0.54) ADORA2AF7NPC1RAB9ASMN1; SMN2
SCHEMBL20485592 0.88 MEN1 (0.63) NPC1RAB9ASMN1; SMN2ALDH1A1HPGD
SCHEMBL29071868 0.86 ALDH1A1 (0.63) NPC1RAB9ASMN1; SMN2ALDH1A1HPGD
SCHEMBL2784089 0.85 RAB9A (0.67) F7NPC1RAB9ASMN1; SMN2ALDH1A1
SCHEMBL4496268 0.84 ALDH1A1 (0.66) ADORA2AF7NPC1RAB9ASMN1; SMN2
SCHEMBL28118423 0.84 ALDH1A1 (0.71) NPC1RAB9ASMN1; SMN2ALDH1A1HPGD
SCHEMBL31429678 0.84 GUSB (0.65) ADORA2AF7NPC1RAB9ASMN1; SMN2
SCHEMBL20485560 0.84 AMY1A (0.51) ADORA2AF7NPC1RAB9ASMN1; 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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113667085-B Impact-resistant anti-aging reflective plastic applied to automobile 深圳市金志成塑胶科技有限公司 2022-09-23 CN claimed
CN-113667085-B Impact-resistant anti-aging reflective plastic applied to automobile 深圳市金志成塑胶科技有限公司 2022-09-23 CN disclosed
CN-113667085-B Impact-resistant anti-aging reflective plastic applied to automobile 深圳市金志成塑胶科技有限公司 2022-09-23 CN disclosed