SCHEMBL22383273

SCHEMBL22383273

Cc1cccc(C(=O)NCCNC(=O)c2cc(C(=O)O)cc(C(=O)O)c2)c1

nearest known ligand 0.71

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ NPC1 O15118 1/20 0.67
▸ RAB9A P51151 1/20 0.67
▸ MEN1 O00255 4/20 0.60
▸ KMT2A Q03164 4/20 0.60
▸ SMN1; SMN2 Q16637 4/20 0.57
▸ POLB P06746 3/20 0.57
▸ LMNA P02545 1/20 0.57
▸ HDAC8 Q9BY41 1/20 0.56
▸ HDAC6 Q9UBN7 1/20 0.56
▸ ATM Q13315 1/20 0.55
▸ GAA P10253 1/20 0.54
▸ KDM4E B2RXH2 1/20 0.54
▸ ALDH1A1 P00352 1/20 0.54
▸ HSD17B10 Q99714 1/20 0.53
▸ KCNK3 O14649 2/20 0.51
▸ KCNK9 Q9NPC2 2/20 0.51
▸ KCNH2 Q12809 1/20 0.51
▸ RXFP1 Q9HBX9 1/20 0.51

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
SCHEMBL14538231 0.84 NPC1 (0.66) NPC1RAB9AMEN1KMT2ASMN1; SMN2
SCHEMBL3199124 0.83 NPC1 (0.68) NPC1RAB9AMEN1KMT2ASMN1; SMN2
SCHEMBL1753828 0.82 L3MBTL1 (0.71) NPC1RAB9AMEN1KMT2ASMN1; SMN2
SCHEMBL9492626 0.82 NPC1 (0.68) NPC1RAB9AMEN1KMT2ASMN1; SMN2
SCHEMBL842631 0.82 NPC1 (0.68) NPC1RAB9AMEN1KMT2ASMN1; SMN2
SCHEMBL12678025 0.81 NPC1 (0.66) NPC1RAB9AMEN1KMT2ASMN1; SMN2
SCHEMBL11234425 0.81 RAB9A (0.66) NPC1RAB9AMEN1KMT2ASMN1; SMN2
SCHEMBL18773997 0.80 NPC1 (1.00) NPC1RAB9AMEN1KMT2ASMN1; SMN2
SCHEMBL21972887 0.80 NPC1 (0.61) NPC1RAB9AMEN1KMT2ASMN1; SMN2
SCHEMBL2668066 0.80 NPC1 (0.61) NPC1RAB9AMEN1KMT2ASMN1; 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10759824-B2 Design, synthesis and use of synthetic nucleotides comprising charge mass tags QUANTUMDX GROUP LIMITED (GB) 2020-09-01 — — 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-10759824-B2 Design, synthesis and use of synthetic nucleotides comprising charge mass tags POLM, RNGTT, TYMP NPC1 4771/4885RAB9A 2763/4885MEN1 2830/4885

“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.

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