SCHEMBL3425844

SCHEMBL3425844

CC(C)CCC[C@H](C)C1CCC2C3CC4OC45C[C@@H](O)CC[C@]5(C)C3CC[C@@]21C

nearest known ligand 0.71

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ NPC1L1 Q9UHC9 10/20 0.71
▸ USP2 O75604 3/20 0.71
▸ LMNA P02545 3/20 0.71
▸ MEN1 O00255 1/20 0.71
▸ TP53 P04637 1/20 0.71
▸ KMT2A Q03164 1/20 0.71
▸ ABCB1 P08183 1/20 0.52
▸ OSBP P22059 1/20 0.52
▸ RORC P51449 1/20 0.52
▸ OSBP2 Q969R2 1/20 0.52
▸ CYP46A1 Q9Y6A2 1/20 0.52
▸ NPC1 O15118 1/20 0.52
▸ POLA1 P09884 1/20 0.51
▸ TOP2A P11388 1/20 0.51
▸ TOP2B Q02880 1/20 0.51
▸ CYP2D6 P10635 1/20 0.50
▸ CYP2C19 P33261 1/20 0.50
▸ PLA2G1B P04054 1/20 0.50
▸ INPP5D Q92835 1/20 0.49
▸ CDC25A P30304 2/20 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
SCHEMBL1918378 1.00 NPC1L1 (0.71) NPC1L1USP2LMNAMEN1TP53
SCHEMBL289077 1.00 NPC1L1 (0.71) NPC1L1USP2LMNAMEN1TP53
SCHEMBL15935529 1.00 NPC1L1 (0.71) NPC1L1USP2LMNAMEN1TP53
SCHEMBL6302509 1.00 NPC1L1 (0.71) NPC1L1USP2LMNAMEN1TP53
SCHEMBL15935854 1.00 NPC1L1 (0.71) NPC1L1USP2LMNAMEN1TP53
SCHEMBL288394 1.00 NPC1L1 (0.71) NPC1L1USP2LMNAMEN1TP53
SCHEMBL9454951 1.00 NPC1L1 (0.71) NPC1L1USP2LMNAMEN1TP53
SCHEMBL2216946 1.00 NPC1L1 (0.71) NPC1L1USP2LMNAMEN1TP53
SCHEMBL10389496 1.00 NPC1L1 (0.71) NPC1L1USP2LMNAMEN1TP53
SCHEMBL19837228 1.00 NPC1L1 (0.71) NPC1L1USP2LMNAMEN1TP53

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20170176446-A1 Methods for Determining the Oncogenic Condition of Cell, Uses Thereof, and Methods for Treating Cancer INSERM (INSTITUT NATIONAL DE LA SANTE ET DE LA RECHERCHE MEDICALE) (FR) 2017-06-22 — — US disclosed
US-20170176446-A1 Methods for Determining the Oncogenic Condition of Cell, Uses Thereof, and Methods for Treating Cancer INSERM (INSTITUT NATIONAL DE LA SANTE ET DE LA RECHERCHE MEDICALE) (FR) 2017-06-22 — — US disclosed
US-20120100124-A1 METHODS FOR DETERMINING THE ONCOGENIC CONDITION OF CELL, USES THEREOF, AND METHODS FOR TREATING CANCER INSERM (INSTITUT NATIONAL DE LA SANTE ET DE LA RECHERCHE MEDICALE) (FR) 2012-04-26 — — US disclosed
US-20120100124-A1 METHODS FOR DETERMINING THE ONCOGENIC CONDITION OF CELL, USES THEREOF, AND METHODS FOR TREATING CANCER INSERM (INSTITUT NATIONAL DE LA SANTE ET DE LA RECHERCHE MEDICALE) (FR) 2012-04-26 — — 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 (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-20170176446-A1 Methods for Determining the Oncogenic Condition of Cell, Uses Thereof, and Methods for Treating Cancer MYC, CCNO, MKI67 NPC1L1 1153/4885USP2 500/4885LMNA 3013/4885
US-20120100124-A1 METHODS FOR DETERMINING THE ONCOGENIC CONDITION OF CELL, USES THEREOF, AND METHODS FOR TREATING CANCER MYC, CCNO, MKI67 NPC1L1 1153/4885USP2 500/4885LMNA 3013/4885

“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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