SCHEMBL18469578

SCHEMBL18469578

Cc1cccc2c1OC(C)(C(C)(C)C)C2

nearest known ligand 0.33

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.33
HTR2C P28335 1/20 0.32
TP53 P04637 1/20 0.31
POLB P06746 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
PKM P14618 2/20 0.30
MEN1 O00255 1/20 0.30
ALDH1A1 P00352 1/20 0.30
KMT2A Q03164 1/20 0.30
NPSR1 Q6W5P4 1/20 0.30

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
SCHEMBL18469522 0.85 ALDH1A1 (0.34) LMNAHTR2CALDH1A1
SCHEMBL435089 0.78 LMNA (0.49) LMNAPOLBSMN1; SMN2PKMMEN1
SCHEMBL17193796 0.75 LMNA (0.34) LMNAHTR2CTP53POLBSMN1; SMN2
SCHEMBL25070406 0.73 CYP2D6 (0.37) LMNATP53SMN1; SMN2PKMMEN1
SCHEMBL18469498 0.73 CYP2D6 (0.37) LMNATP53SMN1; SMN2PKMMEN1
SCHEMBL8473812 0.73 HTR2C (0.34) LMNAHTR2CTP53POLBSMN1; SMN2
SCHEMBL18469483 0.72 CCR8 (0.36) HTR2CALDH1A1
SCHEMBL12301088 0.72 PDK2 (0.35) LMNAHTR2CTP53POLBSMN1; SMN2
SCHEMBL8469239 0.71 POLB (0.33) LMNAHTR2CTP53POLBSMN1; SMN2
SCHEMBL19954245 0.71 POLB (0.33) LMNAHTR2CTP53POLBSMN1; 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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9914724-B2 C-aryl glycosid derivatives, pharmaceutical composition, preparation process and uses thereof Shanghai De Novo Pharmatech Co., Ltd. (CN) 2018-03-13 US disclosed
US-9914724-B2 C-aryl glycosid derivatives, pharmaceutical composition, preparation process and uses thereof Shanghai De Novo Pharmatech Co., Ltd. (CN) 2018-03-13 US disclosed
US-20170037038-A1 C- ARYL GLYCOSID DERIVATIVES, PHARMACEUTICAL COMPOSITION, PREPARATION PROCESS AND USES THEREOF SHANGHAI DE NOVO PHARMATECH CO. LTD. (CN) 2017-02-09 US disclosed
US-20170037038-A1 C- ARYL GLYCOSID DERIVATIVES, PHARMACEUTICAL COMPOSITION, PREPARATION PROCESS AND USES THEREOF SHANGHAI DE NOVO PHARMATECH CO. LTD. (CN) 2017-02-09 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-20170037038-A1 C- ARYL GLYCOSID DERIVATIVES, PHARMACEUTICAL COMPOSITION, PREPARATION PROCESS AND USES THEREOF SLC5A2, SLC5A1, MGAT1 LMNA 3101/4885HTR2C 1269/4885TP53 4666/4885

“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.