SCHEMBL25692779

SCHEMBL25692779

CC(C)(C)Nc1c(NC(=O)OCc2ccccc2)c(=O)c1=O

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ NPC1 O15118 1/20 0.52
▸ RAB9A P51151 1/20 0.52
▸ SMN1; SMN2 Q16637 4/20 0.50
▸ POLB P06746 1/20 0.49
▸ ALDH1A1 P00352 2/20 0.48
▸ CYP1A2 P05177 1/20 0.48
▸ CYP3A4 P08684 1/20 0.48
▸ CYP2D6 P10635 1/20 0.48
▸ CYP2C9 P11712 1/20 0.48
▸ TSHR P16473 1/20 0.48
▸ CYP2C19 P33261 1/20 0.48
▸ HSD17B10 Q99714 1/20 0.48
▸ MGLL Q99685 1/20 0.47
▸ MAOA P21397 1/20 0.46
▸ KAT2B Q92831 1/20 0.46
▸ P2RX7 Q99572 1/20 0.45
▸ LMNA P02545 1/20 0.44
▸ MAOB P27338 1/20 0.44
▸ MEN1 O00255 1/20 0.44
▸ KMT2A Q03164 1/20 0.44

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
SCHEMBL25759211 0.84 NPC1 (0.56) NPC1RAB9ASMN1; SMN2POLBALDH1A1
SCHEMBL13989748 0.83 NPC1 (0.56) NPC1RAB9ASMN1; SMN2POLBALDH1A1
SCHEMBL25693259 0.82 NPC1 (0.54) NPC1RAB9ASMN1; SMN2POLBALDH1A1
SCHEMBL26960329 0.81 NPC1 (0.60) NPC1RAB9ASMN1; SMN2POLBALDH1A1
SCHEMBL25693224 0.81 NPC1 (0.52) NPC1RAB9ASMN1; SMN2POLBALDH1A1
SCHEMBL25693049 0.78 NPC1 (0.52) NPC1RAB9ASMN1; SMN2POLBALDH1A1
SCHEMBL4442846 0.76 KMT2A (0.60) NPC1RAB9ASMN1; SMN2POLBALDH1A1
SCHEMBL16544833 0.73 KMT2A (0.57) NPC1RAB9ASMN1; SMN2POLBALDH1A1
SCHEMBL28564954 0.72 NPC1 (0.64) NPC1RAB9ASMN1; SMN2POLBALDH1A1
SCHEMBL5213739 0.72 NPC1 (0.60) NPC1RAB9ASMN1; SMN2POLBALDH1A1

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-20230202966-A1 ACYCLIC LIPIDS AND METHODS OF USE THEREOF RENAGADE THERAPEUTICS MANAGEMENT INC. 2023-06-29 — — 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-20230202966-A1 ACYCLIC LIPIDS AND METHODS OF USE THEREOF SGMS1, SGMS2, ABHD16A NPC1 73/4885RAB9A 1504/4885SMN1; SMN2 2559/4885

“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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