SCHEMBL18154630

SCHEMBL18154630

CCCCCOC(=O)c1ccc(C(=O)O)o1

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 3/20 0.63
MEN1 O00255 1/20 0.63
KMT2A Q03164 1/20 0.63
TSHR P16473 4/20 0.54
CYP3A4 P08684 2/20 0.54
MAPK1 P28482 2/20 0.54
TP53 P04637 1/20 0.54
ALDH1A1 P00352 5/20 0.53
LMNA P02545 1/20 0.53
NPC1 O15118 1/20 0.49
MAPT P10636 1/20 0.49
RAB9A P51151 1/20 0.49
HDAC4 P56524 1/20 0.49
HDAC6 Q9UBN7 1/20 0.49
L3MBTL1 Q9Y468 2/20 0.47
MMP2 P08253 1/20 0.47
KDM4E B2RXH2 1/20 0.47
POLB P06746 1/20 0.47
HSD17B10 Q99714 1/20 0.47
CNR2 P34972 1/20 0.46

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
SCHEMBL28048610 0.98 MEN1 (0.66) TDP1MEN1KMT2ATSHRCYP3A4
SCHEMBL28825285 0.98 MEN1 (0.66) TDP1MEN1KMT2ATSHRCYP3A4
SCHEMBL27936558 0.98 MEN1 (0.66) TDP1MEN1KMT2ATSHRCYP3A4
SCHEMBL28690901 0.98 MEN1 (0.66) TDP1MEN1KMT2ATSHRCYP3A4
SCHEMBL28691701 0.98 MEN1 (0.66) TDP1MEN1KMT2ATSHRCYP3A4
SCHEMBL136240 0.95 TDP1 (0.56) TDP1MEN1KMT2ATSHRCYP3A4
SCHEMBL18154629 0.93 TSHR (0.61) TDP1MEN1KMT2ATSHRCYP3A4
SCHEMBL16268280 0.92 ALDH1A1 (0.62) TDP1MEN1KMT2ATSHRCYP3A4
SCHEMBL15422580 0.92 ALDH1A1 (0.62) TDP1MEN1KMT2ATSHRCYP3A4
SCHEMBL1357375 0.92 ALDH1A1 (0.62) TDP1MEN1KMT2ATSHRCYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116218168-A Heat-resistant high-strength polylactic acid composite material and preparation method thereof 中国科学院宁波材料技术与工程研究所 2023-06-06 CN claimed
CN-111389414-A Catalyst for preparing carboxylic ester, preparation method thereof and preparation method of carboxylic ester 张磊 2020-07-10 CN disclosed
US-10301276-B2 Method of producing furan carboxylates from aldaric acids by using solid heterogeneous catalyst TEKNOLOGIAN TUTKIMUSKESKUS VTT OY (FI) 2019-05-28 US disclosed
US-20180086728-A1 Method of producing furan carboxylates from aldaric acids by using solid heterogeneous catalyst TEKNOLOGIAN TUTKIMUSKESKUS VTT OY (FI) 2018-03-29 US disclosed
EP-3283471-A1 METHOD OF PRODUCING FURAN CARBOXYLATES FROM ALDARIC ACIDS BY USING SOLID HETEROGENEOUS CATALYSTS Teknologian Tutkimuskeskus VTT Oy (FI) 2018-02-21 EP disclosed
WO-2016166421-A1 METHOD OF PRODUCING FURAN CARBOXYLATES FROM ALDARIC ACIDS BY USING SOLID HETEROGENEOUS CATALYSTS TEKNOLOGIAN TUTKIMUSKESKUS VTT OY (FI) 2016-10-20 WO 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-20180086728-A1 Method of producing furan carboxylates from aldaric acids by using solid heterogeneous catalyst ALDOA, FASN, DERA TDP1 4154/4885MEN1 3082/4885KMT2A 2035/4885
US-10301276-B2 Method of producing furan carboxylates from aldaric acids by using solid heterogeneous catalyst ALDOA, FASN, DERA TDP1 4154/4885MEN1 3082/4885KMT2A 2035/4885

“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.