SCHEMBL21392888

SCHEMBL21392888

O=C(CCl)Nc1ccc(Oc2ccc(-c3ccco3)cc2)cc1

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RNF4 P78317 1/20 0.63
TAAR1 Q96RJ0 3/20 0.63
ALDH1A1 P00352 10/20 0.52
SMN1; SMN2 Q16637 7/20 0.52
NPC1 O15118 5/20 0.52
RAB9A P51151 5/20 0.52
HTT P42858 4/20 0.52
MITF O75030 2/20 0.52
KDM4E B2RXH2 8/20 0.49
MAPT P10636 7/20 0.49
HSD17B10 Q99714 5/20 0.49
HPGD P15428 5/20 0.49
POLB P06746 4/20 0.49
MEN1 O00255 4/20 0.49
KMT2A Q03164 4/20 0.49
MAPK1 P28482 3/20 0.49
TSHR P16473 3/20 0.49
CYP2C19 P33261 2/20 0.49
PIK3CA P42336 1/20 0.49
TDP1 Q9NUW8 1/20 0.49

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
SCHEMBL11806908 0.81 RNF4 (0.86) RNF4ALDH1A1SMN1; SMN2NPC1RAB9A
SCHEMBL3382618 0.78 RNF4 (1.00) RNF4ALDH1A1SMN1; SMN2NPC1RAB9A
SCHEMBL21392894 0.76 L3MBTL1 (0.47) RNF4TAAR1ALDH1A1SMN1; SMN2NPC1
SCHEMBL21392968 0.75 RNF4 (0.76) RNF4ALDH1A1SMN1; SMN2NPC1RAB9A
SCHEMBL23748676 0.74 RNF4 (0.73) RNF4ALDH1A1SMN1; SMN2NPC1RAB9A
SCHEMBL4708278 0.74 TAAR1 (0.67) TAAR1ALDH1A1SMN1; SMN2NPC1RAB9A
SCHEMBL23748680 0.73 RNF4 (0.71) RNF4ALDH1A1SMN1; SMN2NPC1RAB9A
SCHEMBL23748677 0.72 RNF4 (0.75) RNF4ALDH1A1SMN1; SMN2NPC1RAB9A
SCHEMBL31536277 0.72 RNF4 (0.75) RNF4ALDH1A1SMN1; SMN2NPC1RAB9A
SCHEMBL19662081 0.71 TAAR1 (0.53) TAAR1ALDH1A1SMN1; SMN2NPC1RAB9A

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
US-20190290778-A1 METHODS AND COMPOUNDS FOR TARGETED AUTOPHAGY FRONTIER MEDICINES CORPORATION 2019-09-26 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 (1 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-20190290778-A1 METHODS AND COMPOUNDS FOR TARGETED AUTOPHAGY ATG7, BECN1, SQSTM1 RNF4 1274/4885TAAR1 4233/4885ALDH1A1 4188/4885

“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.