SCHEMBL16370342

SCHEMBL16370342

CCC(C)Nc1nc(NC(C)CC)nc(-c2ccccc2)n1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.49
IDH2 P48735 1/20 0.46
TSHR P16473 2/20 0.46
HSD17B10 Q99714 2/20 0.46
NPC1 O15118 2/20 0.46
IDH1 O75874 2/20 0.45
ACP1 P24666 1/20 0.44
LATS1 O95835 3/20 0.43
LATS2 Q9NRM7 3/20 0.43
ADORA3 P0DMS8 1/20 0.43
ADORA2A P29274 1/20 0.43
ADORA1 P30542 1/20 0.43
L3MBTL1 Q9Y468 2/20 0.42
TP53 P04637 1/20 0.42
HSP90AA1 P07900 1/20 0.42
CYP3A4 P08684 1/20 0.42
THRB P10828 1/20 0.42
ALOX15 P16050 1/20 0.42
CASP1 P29466 1/20 0.42
SMN1; SMN2 Q16637 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
SCHEMBL28884135 0.89 NPSR1 (0.56) ALDH1A1TSHRHSD17B10NPC1ADORA3
SCHEMBL29560835 0.86 IDH2 (0.52) IDH2TSHRHSD17B10NPC1IDH1
SCHEMBL15102522 0.86 IDH2 (0.52) IDH2TSHRHSD17B10NPC1IDH1
SCHEMBL13309919 0.78 ADORA1 (0.61) ALDH1A1ADORA3ADORA2AADORA1L3MBTL1
SCHEMBL15102357 0.77 KCNH3 (0.70) IDH2KCNH3MEN1KMT2A
SCHEMBL4866926 0.76 ACP1 (0.73) ALDH1A1NPC1ACP1LATS1LATS2
SCHEMBL29904029 0.76 KCNH3 (0.60) IDH2KCNH3
SCHEMBL15131484 0.76 NPC1 (0.56) TSHRHSD17B10NPC1IDH1ACP1
SCHEMBL15102398 0.75 IDH2 (0.57) IDH2IDH1KCNH3MEN1KMT2A
SCHEMBL29763468 0.74 KCNH3 (0.52) IDH2KCNH3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3686190-A1 SYNTHESIS OF THERAPEUTICALLY ACTIVE COMPOUNDS Agios Pharmaceuticals, Inc. (US) 2020-07-29 EP claimed
EP-3019483-B1 THERAPEUTICALLY ACTIVE COMPOUNDS AND THEIR METHODS OF USE AGIOS PHARMACEUTICALS INC (US) 2019-11-20 EP claimed
US-12433895-B2 Therapeutically active compounds and their methods of use SERVIER PHARMACEUTICALS LLC (US) 2025-10-07 US disclosed
US-20240335448-A1 THERAPEUTICALLY ACTIVE COMPOUNDS AND THEIR METHODS OF USE PHARMARESROUCES (SHANGHAI) CO., LTD. (CN) 2024-10-10 US disclosed
US-11844758-B2 Therapeutically active compounds and their methods of use SERVIER PHARMACEUTICALS LLC (US) 2023-12-19 US disclosed
US-20220354856-A1 THERAPEUTICALLY ACTIVE COMPOUNDS AND THEIR METHODS OF USE SERVIER PHARMACEUTICALS LLC 2022-11-10 US disclosed
US-10946023-B2 Therapeutically active compounds and their methods of use AGIOS PHARMACEUTICALS, INC. (US) 2021-03-16 US disclosed
EP-3686190-A1 SYNTHESIS OF THERAPEUTICALLY ACTIVE COMPOUNDS Agios Pharmaceuticals, Inc. (US) 2020-07-29 EP disclosed
EP-3019483-B1 THERAPEUTICALLY ACTIVE COMPOUNDS AND THEIR METHODS OF USE AGIOS PHARMACEUTICALS INC (US) 2019-11-20 EP disclosed
US-20190117661-A1 THERAPEUTICALLY ACTIVE COMPOUNDS AND THEIR METHODS OF USE SERVIER PHARMACEUTICALS LLC 2019-04-25 US disclosed
US-10172864-B2 Therapeutically active compounds and their methods of use AGIOS PHARMACEUTICALS, INC. (US) 2019-01-08 US disclosed
US-10028961-B2 Therapeutically active compounds and their methods of use AGIOS PHARMACEUTICALS, INC. (US) 2018-07-24 US disclosed
US-20170107194-A1 THERAPEUTICALLY ACTIVE COMPOUNDS AND THEIR METHODS OF USE SERVIER PHARMACEUTICALS LLC 2017-04-20 US disclosed
US-20160220572-A1 THERAPEUTICALLY ACTIVE COMPOUNDS AND THEIR METHODS OF USE SERVIER PHARMACEUTICALS LLC 2016-08-04 US disclosed
EP-3019483-A1 THERAPEUTICALLY ACTIVE COMPOUNDS AND THEIR METHODS OF USE Agios Pharmaceuticals, Inc. (US) 2016-05-18 EP disclosed
WO-2015003640-A1 THERAPEUTICALLY ACTIVE COMPOUNDS AND THEIR METHODS OF USE AGIOS PHARMACEUTICALS, INC. (US) 2015-01-15 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 (10 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-20190117661-A1 THERAPEUTICALLY ACTIVE COMPOUNDS AND THEIR METHODS OF USE MCL1, TP53, BRDT ALDH1A1 923/4885IDH2 110/4885TSHR 3788/4885
US-12433895-B2 Therapeutically active compounds and their methods of use MCL1, TP53, BRDT ALDH1A1 923/4885IDH2 110/4885TSHR 3788/4885
US-11844758-B2 Therapeutically active compounds and their methods of use MCL1, TP53, BRDT ALDH1A1 923/4885IDH2 110/4885TSHR 3788/4885
US-10028961-B2 Therapeutically active compounds and their methods of use MCL1, TP53, BRDT ALDH1A1 923/4885IDH2 110/4885TSHR 3788/4885
US-10172864-B2 Therapeutically active compounds and their methods of use MCL1, TP53, BRDT ALDH1A1 923/4885IDH2 110/4885TSHR 3788/4885
US-20240335448-A1 THERAPEUTICALLY ACTIVE COMPOUNDS AND THEIR METHODS OF USE MCL1, TP53, BRDT ALDH1A1 923/4885IDH2 110/4885TSHR 3788/4885
US-10946023-B2 Therapeutically active compounds and their methods of use MCL1, TP53, BRDT ALDH1A1 923/4885IDH2 110/4885TSHR 3788/4885
US-20160220572-A1 THERAPEUTICALLY ACTIVE COMPOUNDS AND THEIR METHODS OF USE MCL1, TP53, BRDT ALDH1A1 923/4885IDH2 110/4885TSHR 3788/4885
US-20170107194-A1 THERAPEUTICALLY ACTIVE COMPOUNDS AND THEIR METHODS OF USE MCL1, TP53, BRDT ALDH1A1 923/4885IDH2 110/4885TSHR 3788/4885
US-20220354856-A1 THERAPEUTICALLY ACTIVE COMPOUNDS AND THEIR METHODS OF USE MCL1, TP53, BRDT ALDH1A1 923/4885IDH2 110/4885TSHR 3788/4885

“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.