SCHEMBL19002043

SCHEMBL19002043

CCC(=O)c1ccc(N2CCC[C@H](C)C2)cc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 3/20 0.50
ALDH1A1 P00352 9/20 0.48
MAPT P10636 6/20 0.48
HPGD P15428 3/20 0.48
LMNA P02545 2/20 0.48
TAAR1 Q96RJ0 1/20 0.48
GAA P10253 2/20 0.47
HTT P42858 2/20 0.47
USP2 O75604 1/20 0.47
KMT2A Q03164 2/20 0.46
AGTR1 P30556 1/20 0.45
TSHR P16473 1/20 0.44
MAPK1 P28482 2/20 0.43
KDM4E B2RXH2 2/20 0.43
RAB9A P51151 2/20 0.43
RECQL P46063 1/20 0.43
MEN1 O00255 1/20 0.42
ADRA1A P35348 1/20 0.42
NPC1 O15118 1/20 0.42
TP53 P04637 1/20 0.42

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
SCHEMBL18987098 1.00 SMN1; SMN2 (0.50) SMN1; SMN2ALDH1A1MAPTHPGDLMNA
SCHEMBL19002070 1.00 SMN1; SMN2 (0.50) SMN1; SMN2ALDH1A1MAPTHPGDLMNA
SCHEMBL27790848 0.84 USP2 (0.67) SMN1; SMN2ALDH1A1MAPTHPGDLMNA
SCHEMBL13004910 0.84 KMT2A (0.54) SMN1; SMN2ALDH1A1MAPTGAAUSP2
SCHEMBL19002044 0.82 USP2 (0.69) SMN1; SMN2ALDH1A1MAPTHPGDLMNA
SCHEMBL16564077 0.81 HTT (0.57) SMN1; SMN2ALDH1A1MAPTHPGDLMNA
SCHEMBL10505311 0.81 HTT (0.61) SMN1; SMN2ALDH1A1MAPTHPGDLMNA
SCHEMBL15630932 0.80 ALDH1A1 (0.54) SMN1; SMN2ALDH1A1MAPTHPGDGAA
SCHEMBL27812550 0.80 ALDH1A1 (0.54) SMN1; SMN2ALDH1A1MAPTHPGDGAA
SCHEMBL2201934 0.80 HTT (0.64) SMN1; SMN2ALDH1A1MAPTHPGDLMNA

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10799494-B2 Combination of respiratory electron transport chain inhibitors with a cytochrome bd inhibitor LIVERPOOL SCHOOL TROPICAL MEDICINE (GB) 2020-10-13 US disclosed
US-10799494-B2 Combination of respiratory electron transport chain inhibitors with a cytochrome bd inhibitor LIVERPOOL SCHOOL TROPICAL MEDICINE (GB) 2020-10-13 US disclosed
US-20190151305-A1 COMBINATION PRODUCT LIVERPOOL SCHOOL TROPICAL MEDICINE (GB) 2019-05-23 US disclosed
US-20190151305-A1 COMBINATION PRODUCT LIVERPOOL SCHOOL TROPICAL MEDICINE (GB) 2019-05-23 US disclosed
WO-2017103615-A1 COMBINATION PRODUCT LIVERPOOL SCHOOL OF TROPICAL MEDICINE (GB) 2017-06-22 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-10799494-B2 Combination of respiratory electron transport chain inhibitors with a cytochrome bd inhibitor NDUFB7, NDUFB3, NDUFB5 SMN1; SMN2 4817/4885ALDH1A1 846/4885MAPT 1315/4885
US-20190151305-A1 COMBINATION PRODUCT NDUFB5, NDUFB7, NDUFB10 SMN1; SMN2 4400/4885ALDH1A1 857/4885MAPT 1113/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.