SCHEMBL18526953

SCHEMBL18526953

COCOc1ccc(COCC(=O)c2ccccc2)c(O)c1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 3/20 0.45
RAB9A P51151 3/20 0.45
MAPT P10636 3/20 0.45
SMN1; SMN2 Q16637 2/20 0.45
MEN1 O00255 4/20 0.42
KMT2A Q03164 4/20 0.42
HPGD P15428 3/20 0.42
ALDH1A1 P00352 3/20 0.42
KDM4E B2RXH2 2/20 0.42
LMNA P02545 2/20 0.42
TP53 P04637 1/20 0.42
ALOX12 P18054 1/20 0.42
HSD17B10 Q99714 1/20 0.42
ESR2 Q92731 2/20 0.42
ESR1 P03372 1/20 0.42
POLB P06746 2/20 0.40
CYP1A2 P05177 1/20 0.40
PGR P06401 1/20 0.40
CYP2D6 P10635 1/20 0.40
SLC6A2 P23975 1/20 0.40

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
SCHEMBL1962773 0.82 SMN1; SMN2 (0.52) NPC1RAB9AMAPTSMN1; SMN2MEN1
SCHEMBL1962776 0.79 MAOB (0.52) NPC1RAB9AMAPTSMN1; SMN2ALDH1A1
SCHEMBL18526954 0.78 MAOB (0.56) NPC1RAB9AMAPTSMN1; SMN2MEN1
SCHEMBL12532252 0.77 NPC1 (0.60) NPC1RAB9AMAPTSMN1; SMN2MEN1
SCHEMBL15619542 0.76 ESR1 (0.50) NPC1RAB9AMAPTSMN1; SMN2MEN1
SCHEMBL1930256 0.74 NPC1 (0.50) NPC1RAB9AMAPTSMN1; SMN2MEN1
SCHEMBL10552882 0.73 MAPT (0.47) NPC1RAB9AMAPTSMN1; SMN2MEN1
SCHEMBL10432798 0.73 MAPT (0.50) NPC1RAB9AMAPTSMN1; SMN2ALDH1A1
SCHEMBL29183304 0.73 NPC1 (0.53) NPC1RAB9AMAPTSMN1; SMN2MEN1
SCHEMBL11565253 0.72 LMNA (0.50) NPC1RAB9AMAPTSMN1; SMN2MEN1

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-10058582-B2 Therapeutic molecules and deviates for CRC ANTARTINA LLC (US) 2018-08-28 US disclosed
EP-3337493-A1 NEW THERAPEUTIC MOLECULES & DEVIATES FOR CRC Antartina LLC (US) 2018-06-27 EP disclosed
WO-2017031054-A1 NEW THERAPEUTIC MOLECULES & DEVIATES FOR CRC ANTARTINA LLC (US) 2017-02-23 WO disclosed
US-20170049839-A1 Therapeutic molecules & deviates for CRC NEOCAGE SL (AD) 2017-02-23 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-10058582-B2 Therapeutic molecules and deviates for CRC DLD, APC, SEPTIN7 NPC1 228/4885RAB9A 1199/4885MAPT 2519/4885

“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.