SCHEMBL4968677

SCHEMBL4968677

CCC1Oc2c(C(C)C)cccc2N(CC(=O)OC)C1=O

nearest known ligand 0.53

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 1/20 0.46
TSHR P16473 5/20 0.46
HTT P42858 2/20 0.46
MAPT P10636 1/20 0.46
TP53 P04637 3/20 0.42
ALOX15 P16050 1/20 0.42
HSD17B10 Q99714 1/20 0.42
LMNA P02545 2/20 0.41
KMT2A Q03164 1/20 0.41
ALDH1A1 P00352 2/20 0.41
L3MBTL1 Q9Y468 2/20 0.41
GAA P10253 1/20 0.41
POLB P06746 1/20 0.40
THRB P10828 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
GLA P06280 1/20 0.39

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
SCHEMBL4972716 0.89 RAB9A (0.41) MAPK1TSHRHTTMAPTTP53
SCHEMBL4967405 0.87 ALOX15 (0.55) MAPK1TSHRHTTMAPTTP53
SCHEMBL4970662 0.85 MEN1 (0.41) TSHRLMNAKMT2AALDH1A1POLB
SCHEMBL10358621 0.85 MEN1 (0.41) TSHRLMNAKMT2AALDH1A1POLB
SCHEMBL4970655 0.83 TSHR (0.40) TSHRLMNAKMT2AALDH1A1L3MBTL1
SCHEMBL4969055 0.81 ALOX15 (0.42) MAPK1TSHRHTTMAPTTP53
SCHEMBL10359000 0.78 POLB (0.38) TSHRALOX15HSD17B10LMNAKMT2A
SCHEMBL10359001 0.78 POLB (0.38) TSHRALOX15HSD17B10LMNAKMT2A
SCHEMBL4970803 0.76 ALOX12 (0.47) TSHRHTTLMNAKMT2AALDH1A1
SCHEMBL4968858 0.75 POLB (0.47) TP53LMNAKMT2AALDH1A1L3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1985297-A1 CARBOXYLIC ACID COMPOUND AND USE THEREOF Japan Tobacco, Inc. (JP) 2008-10-29 EP disclosed
US-20070197512-A1 Carboxylic Acid Compounds and Use Thereof JAPAN TOBACCO INC. (JP) 2007-08-23 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-20070197512-A1 Carboxylic Acid Compounds and Use Thereof GLS, SLC10A1, SOAT1 MAPK1 1189/4885TSHR 4003/4885HTT 772/4885

“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.