SCHEMBL801701

SCHEMBL801701

COCCOc1ccc(C(C)C)cc1

nearest known ligand 0.53

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.53
KMT2A Q03164 3/20 0.53
L3MBTL1 Q9Y468 1/20 0.47
LMNA P02545 1/20 0.46
HTT P42858 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
MAOB P27338 2/20 0.46
TDP1 Q9NUW8 2/20 0.46
RXRA P19793 1/20 0.44
RXRB P28702 1/20 0.44
RAB9A P51151 2/20 0.43
NPC1 O15118 1/20 0.43
KDM4E B2RXH2 2/20 0.43
ACACB O00763 1/20 0.42
RECQL P46063 1/20 0.42

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
SCHEMBL13981330 0.94 KDM4E (0.50) MEN1KMT2AL3MBTL1LMNAHTT
SCHEMBL15275317 0.94 KDM4E (0.50) MEN1KMT2AL3MBTL1LMNAHTT
SCHEMBL18127062 0.94 KDM4E (0.50) MEN1KMT2AL3MBTL1LMNAHTT
SCHEMBL10824702 0.91 KMT2A (0.59) MEN1KMT2ALMNAHTTSMN1; SMN2
SCHEMBL12089422 0.90 MEN1 (0.56) MEN1KMT2AL3MBTL1LMNAHTT
SCHEMBL12855509 0.86 KMT2A (0.45) MEN1KMT2AL3MBTL1LMNAHTT
SCHEMBL25607224 0.85 APP (0.56) KMT2AL3MBTL1RXRARXRBRAB9A
SCHEMBL18126830 0.85 KMT2A (0.51) MEN1KMT2AL3MBTL1LMNAHTT
SCHEMBL14579974 0.85 MEN1 (0.62) MEN1KMT2ALMNAHTTSMN1; SMN2
SCHEMBL10593412 0.85 MEN1 (0.62) MEN1KMT2AL3MBTL1LMNAHTT

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 71 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11840527-B2 Non-fused thiophene derivatives and their uses ENYO PHARMA (FR) 2023-12-12 US disclosed
US-11819476-B2 Rapamycin analogs and uses thereof JANSSEN PHARMACEUTICA NV (BE) 2023-11-21 US disclosed
US-11819476-B2 Rapamycin analogs and uses thereof JANSSEN PHARMACEUTICA NV (BE) 2023-11-21 US disclosed
US-20230174520-A1 3-((Hetero-)Aryl)-Alkyl-8-Amino-2-Oxo-1,3-Diaza-Spiro-[4.5]-Decane Derivatives GRUENENTHAL GMBH (DE) 2023-06-08 US disclosed
WO-2023096987-A1 BRM TARGETING COMPOUNDS AND ASSOCIATED METHODS OF USE ARVINAS OPERATIONS, INC. (US) 2023-06-01 WO disclosed
US-20230024108-A1 ADENOSINE A2A RECEPTOR ANTAGONISTS TEON THERAPEUTICS INC (US) 2023-01-26 US disclosed
US-20220267352-A1 RAPAMYCIN ANALOGS AND USES THEREOF JANSSEN PHARMACEUTICA NV (BE) 2022-08-25 US disclosed
WO-2022120207-A1 BROAD SPECTRUM ANTIVIRAL COMPOUNDS TARGETING THE SKI COMPLEX UNIVERSITY OF MARYLAND, BALTIMORE (US) 2022-06-09 WO disclosed
US-20220153724-A1 Inhibitors Of Plasma Kallikrein KALVISTA PHARMACEUTICALS LTD (GB) 2022-05-19 US disclosed
US-11242333-B2 Inhibitors of plasma kallikrein KALVISTA PHARMACEUTICALS LIMITED (GB) 2022-02-08 US disclosed
US-20110038876-A1 HETEROCYCLIC COMPOUNDS AND USE THEREOF AS ERK INHIBITORS SCHERING CORPORATION 2011-02-17 US disclosed
US-7763624-B2 Substituted pyrazolo[3,4-d]pyrimidines as ACK-1 and LCK inhibitors AMGEN INC. (US) 2010-07-27 US disclosed
US-20090076088-A1 Thrombin Receptor Antagonists SCHERING CORPORATION 2009-03-19 US disclosed
US-20090076088-A1 Thrombin Receptor Antagonists SCHERING CORPORATION 2009-03-19 US disclosed
US-20090069383-A1 Thrombin Receptor Antagonists SCHERING CORPORATION 2009-03-12 US disclosed
US-7488742-B2 Thrombin receptor antagonists SCHERING CORPORATION (US) 2009-02-10 US disclosed
US-7488742-B2 Thrombin receptor antagonists SCHERING CORPORATION (US) 2009-02-10 US disclosed
US-20070072851-A1 Pyrazolopyridine and pyrazolopyrimidine compounds AMGEN INC. (US) 2007-03-29 US disclosed
US-20040152736-A1 Thrombin receptor antagonists TOPROL ACQUISITION LLC 2004-08-05 US disclosed
US-20040152736-A1 Thrombin receptor antagonists TOPROL ACQUISITION LLC 2004-08-05 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 (12 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-20110038876-A1 HETEROCYCLIC COMPOUNDS AND USE THEREOF AS ERK INHIBITORS MAPK1, MAPK4, MAPK10 MEN1 1757/4885KMT2A 1600/4885L3MBTL1 3442/4885
US-20230174520-A1 3-((Hetero-)Aryl)-Alkyl-8-Amino-2-Oxo-1,3-Diaza-Spiro-[4.5]-Decane Derivatives OPRK1, OPRD1, ARRB1 MEN1 3999/4885KMT2A 2715/4885L3MBTL1 3714/4885
US-20090076088-A1 Thrombin Receptor Antagonists CNR1, CNR2, TBXA2R MEN1 3544/4885KMT2A 4013/4885L3MBTL1 4669/4885
US-20220267352-A1 RAPAMYCIN ANALOGS AND USES THEREOF RICTOR, MTOR, RPTOR MEN1 241/4885KMT2A 3977/4885L3MBTL1 1577/4885
US-20220153724-A1 Inhibitors Of Plasma Kallikrein KLKB1, SERPINB1, KLK5 MEN1 431/4885KMT2A 1476/4885L3MBTL1 423/4885
US-11242333-B2 Inhibitors of plasma kallikrein KLKB1, SERPINB1, KLK5 MEN1 431/4885KMT2A 1476/4885L3MBTL1 423/4885
US-20230024108-A1 ADENOSINE A2A RECEPTOR ANTAGONISTS ADORA2A, ADORA2B, ADORA3 MEN1 4350/4885KMT2A 2575/4885L3MBTL1 3210/4885
US-20040152736-A1 Thrombin receptor antagonists CNR1, TBXA2R, CNR2 MEN1 3101/4885KMT2A 4099/4885L3MBTL1 4370/4885
US-20090069383-A1 Thrombin Receptor Antagonists CNR1, CNR2, TBXA2R MEN1 3544/4885KMT2A 4013/4885L3MBTL1 4669/4885
US-11819476-B2 Rapamycin analogs and uses thereof RICTOR, MTOR, RPTOR MEN1 286/4885KMT2A 3789/4885L3MBTL1 2979/4885
US-20070072851-A1 Pyrazolopyridine and pyrazolopyrimidine compounds LCK, MAP4K5, TPMT MEN1 1368/4885KMT2A 2887/4885L3MBTL1 4245/4885
US-11840527-B2 Non-fused thiophene derivatives and their uses FTH1, SLC40A1, FECH MEN1 3578/4885KMT2A 3273/4885L3MBTL1 969/4885

“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.