SCHEMBL10436085

SCHEMBL10436085

C=CCNC(=O)C(C)C(=O)C=C

nearest known ligand 0.43

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ HPGD P15428 1/20 0.43
▸ HSD17B10 Q99714 1/20 0.43
▸ SMN1; SMN2 Q16637 4/20 0.41
▸ TSHR P16473 3/20 0.41
▸ MAPT P10636 2/20 0.41
▸ ALDH1A1 P00352 3/20 0.39
▸ ATM Q13315 1/20 0.39
▸ NPSR1 Q6W5P4 1/20 0.39
▸ KMT2A Q03164 1/20 0.38
▸ FAAH O00519 1/20 0.38
▸ RAB9A P51151 2/20 0.37
▸ NPC1 O15118 1/20 0.37
▸ ALPL P05186 1/20 0.37
▸ HTT P42858 1/20 0.35
▸ POLB P06746 1/20 0.35
▸ PKM P14618 1/20 0.34

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
SCHEMBL3459597 0.82 HPGD (0.44) HPGDHSD17B10SMN1; SMN2TSHRMAPT
SCHEMBL787343 0.79 — —
SCHEMBL3460423 0.77 HPGD (0.41) HPGDHSD17B10SMN1; SMN2TSHRMAPT
Hydrochloric Acid SCHEMBL27749339 0.77 HPGD (0.46) HPGDHSD17B10SMN1; SMN2TSHRMAPT
SCHEMBL2308779 0.77 — —
SCHEMBL13714091 0.75 MAPT (0.48) HPGDHSD17B10SMN1; SMN2TSHRMAPT
SCHEMBL29258687 0.75 — —
SCHEMBL19198544 0.75 — —
SCHEMBL12344727 0.75 — —
SCHEMBL29258847 0.75 — —

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0376650-A2 Liquid developer for electrostatic photography FUJI PHOTO FILM CO., LTD. (JP) 1990-07-04 — — EP disclosed
Send feedback