SCHEMBL436000

SCHEMBL436000

O=C(O)c1cccc2c1OCc1occc1-2

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PARP1 P09874 1/20 0.44
HSD17B10 Q99714 2/20 0.38
HNF4A P41235 1/20 0.36
ALDH1A1 P00352 4/20 0.35
L3MBTL1 Q9Y468 3/20 0.35
MAPT P10636 2/20 0.35
MYC P01106 1/20 0.35
LMNA P02545 1/20 0.35
ALOX15 P16050 1/20 0.34
POLB P06746 2/20 0.34
KMT2A Q03164 1/20 0.34
GAA P10253 1/20 0.34
LIG1 P18858 1/20 0.33
TYMS P04818 1/20 0.33
HSP90AA1 P07900 1/20 0.32
TSHR P16473 1/20 0.32
NR4A1 P22736 1/20 0.32
NR4A2 P43354 1/20 0.32
NR4A3 Q92570 1/20 0.32
PKM P14618 1/20 0.32

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
SCHEMBL14937360 0.85 PARP1 (0.41) PARP1HSD17B10HNF4AALDH1A1L3MBTL1
SCHEMBL20510040 0.76 PARP1 (0.73) PARP1HSD17B10HNF4AALDH1A1L3MBTL1
SCHEMBL436709 0.74 PARP1 (0.40) PARP1HSD17B10HNF4AALDH1A1L3MBTL1
SCHEMBL11094419 0.70 PARP1 (0.49) PARP1HSD17B10ALDH1A1MAPTALOX15
SCHEMBL436710 0.68 HSD17B10 (0.36) HSD17B10HNF4AALDH1A1L3MBTL1MAPT
SCHEMBL6836766 0.67 PARP1 (0.51) PARP1HSD17B10HNF4AALDH1A1L3MBTL1
SCHEMBL5449123 0.64 ALDH1A1 (0.44) PARP1HSD17B10HNF4AALDH1A1L3MBTL1
SCHEMBL28290216 0.64 MYC (0.49) HNF4AALDH1A1L3MBTL1MYCLMNA
SCHEMBL31364686 0.62 SMYD3 (0.57) PARP1ALDH1A1MAPTLMNAKMT2A
SCHEMBL251991 0.61 KDM4E (0.56) PARP1HSD17B10ALDH1A1ALOX15HPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2595988-A1 TRICYCLIC COMPOUNDS AND METHDS OF MAKING AND USING SAME Zafgen, Inc. (US) 2013-05-29 EP claimed
WO-2012012642-A1 TRICYCLIC COMPOUNDS AND METHDS OF MAKING AND USING SAME ZAFGEN CORPORATION (US) 2012-01-26 WO claimed
US-20230404963-A1 COMBINATIONS OF METAP2 INHIBITORS AND CD4/6 INHIBITORS FOR THE TREATMENT OF CANCER SYNDEVRX, INC. 2023-12-21 US disclosed
US-9839623-B2 Tricyclic compounds and methods of making and using same ZAFGEN, INC. (US) 2017-12-12 US disclosed
US-20160354338-A1 TRICYCLIC COMPOUNDS AND METHODS OF MAKING AND USING SAME ZAFGEN INC (US) 2016-12-08 US disclosed
US-9266896-B2 Tricyclic compounds and methods of making and using same ZAFGEN, INC. (US) 2016-02-23 US disclosed
EP-2595988-A1 TRICYCLIC COMPOUNDS AND METHDS OF MAKING AND USING SAME Zafgen, Inc. (US) 2013-05-29 EP disclosed
US-20130123235-A1 Tricyclic Compounds and Methods of Making and Using Same ZAFGEN, INC. 2013-05-16 US disclosed
WO-2012012642-A1 TRICYCLIC COMPOUNDS AND METHDS OF MAKING AND USING SAME ZAFGEN CORPORATION (US) 2012-01-26 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 (3 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-20230404963-A1 COMBINATIONS OF METAP2 INHIBITORS AND CD4/6 INHIBITORS FOR THE TREATMENT OF CANCER CDK6, MPHOSPH6, CD4 PARP1 876/4885HSD17B10 4634/4885HNF4A 1404/4885
US-20130123235-A1 Tricyclic Compounds and Methods of Making and Using Same CES2, DNPEP, METAP2 PARP1 988/4885HSD17B10 328/4885HNF4A 3112/4885
US-20160354338-A1 TRICYCLIC COMPOUNDS AND METHODS OF MAKING AND USING SAME CES2, DNPEP, METAP2 PARP1 988/4885HSD17B10 328/4885HNF4A 3112/4885

“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.