SCHEMBL19204427

SCHEMBL19204427

O=C(NNc1ccccc1)C1CC=CCC1C(O)O

nearest known ligand 0.68

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 7/20 0.68
GAA P10253 7/20 0.68
POLB P06746 3/20 0.48
TDP1 Q9NUW8 2/20 0.48
TSHR P16473 2/20 0.41
CYP3A4 P08684 1/20 0.41
ALOX5 P09917 1/20 0.41
ALDH1A1 P00352 7/20 0.40
MAPT P10636 1/20 0.40
HPGD P15428 1/20 0.40
METAP2 P50579 1/20 0.40
PTGS2 P35354 1/20 0.40
LMNA P02545 2/20 0.39
P2RX7 Q99572 1/20 0.39
HSD17B10 Q99714 1/20 0.38
HTT P42858 1/20 0.38
PKM P14618 1/20 0.38
KDM4E B2RXH2 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
SCHEMBL21160881 0.81 SMN1; SMN2 (1.00) SMN1; SMN2GAAPOLBTDP1TSHR
SCHEMBL19204354 0.81 SMN1; SMN2 (1.00) SMN1; SMN2GAAPOLBTDP1TSHR
SCHEMBL22017754 0.78 GAA (0.51) SMN1; SMN2GAAPOLBTSHRCYP3A4
SCHEMBL3600320 0.71 GAA (0.71) SMN1; SMN2GAAPOLBTDP1TSHR
SCHEMBL3605433 0.71 GAA (0.71) SMN1; SMN2GAAPOLBTDP1TSHR
SCHEMBL24506992 0.69 POLB (0.39) SMN1; SMN2GAAPOLBTDP1TSHR
SCHEMBL21160883 0.69 GAA (0.67) SMN1; SMN2GAAPOLBTDP1TSHR
SCHEMBL19204353 0.69 GAA (0.67) SMN1; SMN2GAAPOLBTDP1TSHR
SCHEMBL22017807 0.68 GAA (0.65) SMN1; SMN2GAAPOLBTDP1TSHR
SCHEMBL19204430 0.68 GAA (0.65) SMN1; SMN2GAAPOLBTDP1TSHR

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-10662147-B2 Phenylhydrazine/anhydride adducts and anaerobic curable compositions using same Henkel IP & Holding GmbH (DE) 2020-05-26 US disclosed
US-20170217879-A1 PHENYLHYDRAZINE/ANHYDRIDE ADDUCTS AND ANAEROBIC CURABLE COMPOSITIONS USING SAME HENKEL AG & CO. KGAA (DE) 2017-08-03 US 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-10662147-B2 Phenylhydrazine/anhydride adducts and anaerobic curable compositions using same AHCY, BAP1, GLO1 SMN1; SMN2 2004/4885GAA 2944/4885POLB 730/4885
US-20170217879-A1 PHENYLHYDRAZINE/ANHYDRIDE ADDUCTS AND ANAEROBIC CURABLE COMPOSITIONS USING SAME AHCY, BAP1, GLO1 SMN1; SMN2 2004/4885GAA 2944/4885POLB 730/4885

“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.