Enasidenib

Enasidenib

SCHEMBL17891027

[2H]C([2H])([2H])C(O)(CNc1nc(Nc2ccnc(C(F)(F)F)c2)nc(-c2cccc(C(F)(F)F)n2)n1)C([2H])([2H])[2H]

nearest known ligand 0.87

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

IDH2

The experimentally established mechanism targets of Enasidenib. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ IDH2 known ✓ P48735 13/20 0.87
▸ IDH1 O75874 13/20 0.87
▸ ABCB11 O95342 1/20 0.87
▸ ADORA3 P0DMS8 1/20 0.87
▸ CHRM1 P11229 1/20 0.87
▸ TBXA2R P21731 1/20 0.87
▸ PTGS1 P23219 1/20 0.87
▸ ADORA1 P30542 1/20 0.87
▸ ADRA1A P35348 1/20 0.87
▸ OPRM1 P35372 1/20 0.87
▸ KDR P35968 1/20 0.87
▸ KCNH2 Q12809 1/20 0.87

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
Enasidenib SCHEMBL29360046 0.93 IDH2 (1.00) IDH2IDH1ABCB11ADORA3CHRM1
Enasidenib SCHEMBL15102202 0.93 IDH2 (1.00) IDH2IDH1ABCB11ADORA3CHRM1
SCHEMBL18774522 0.93 IDH2 (0.75) IDH2IDH1ABCB11ADORA3CHRM1
SCHEMBL18774523 0.90 IDH2 (0.77) IDH2IDH1ABCB11ADORA3CHRM1
SCHEMBL15102425 0.90 IDH1 (0.93) IDH2IDH1ABCB11ADORA3CHRM1
SCHEMBL15102444 0.90 IDH1 (0.93) IDH2IDH1ABCB11ADORA3CHRM1
Enasidenib SCHEMBL29773080 0.89 IDH2 (1.00) IDH2IDH1ABCB11ADORA3CHRM1
Enasidenib SCHEMBL16448052 0.89 IDH2 (1.00) IDH2IDH1ABCB11ADORA3CHRM1
SCHEMBL18774538 0.88 IDH2 (0.68) IDH2IDH1ABCB11ADORA3CHRM1
Enasidenib SCHEMBL30885350 0.88 IDH2 (0.82) IDH2IDH1ABCB11ADORA3CHRM1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3932408-A1 THERAPEUTICALLY ACTIVE COMPOUNDS AND THEIR METHODS OF USE Agios Pharmaceuticals, Inc. (US) 2022-01-05 — — EP disclosed
EP-3566706-B1 THERAPEUTICALLY ACTIVE COMPOUNDS AND THEIR METHODS OF USE AGIOS PHARMACEUTICALS INC (US) 2021-07-14 — — EP disclosed
US-10730854-B2 Therapeutically active compounds and their methods of use AGIOS PHARMACEUTICALS, INC. (US) 2020-08-04 — — US disclosed
EP-3566706-A1 THERAPEUTICALLY ACTIVE COMPOUNDS AND THEIR METHODS OF USE Agios Pharmaceuticals, Inc. (US) 2019-11-13 — — EP disclosed
US-10201543-B2 Therapeutically active compounds and their methods of use AGIOS PHARMACEUTICALS, INC. (US) 2019-02-12 — — US disclosed
US-20180370951-A1 THERAPEUTICALLY ACTIVE COMPOUNDS AND THEIR METHODS OF USE SERVIER PHARMACEUTICALS LLC 2018-12-27 — — US disclosed
US-10105369-B2 Therapeutically active compounds and their methods of use AGIOS PHARMACEUTICALS, INC. (US) 2018-10-23 — — US disclosed
US-10093654-B2 Therapeutically active compounds and their methods of use AGIOS PHARMACEUTICALS, INC. (US) 2018-10-09 — — US disclosed
US-20180125850-A1 THERAPEUTICALLY ACTIVE COMPOUNDS AND THEIR METHODS OF USE SERVIER PHARMACEUTICALS LLC 2018-05-10 — — US disclosed
US-9889137-B2 Therapeutically active compounds and their methods of use AGIOS PHARMACEUTICALS, INC. (US) 2018-02-13 — — US disclosed
US-20180028539-A1 THERAPEUTICALLY ACTIVE COMPOUNDS AND THEIR METHODS OF USE SERVIER PHARMACEUTICALS LLC 2018-02-01 — — US disclosed
US-20170305885-A1 THERAPEUTICALLY ACTIVE COMPOUNDS AND THEIR METHODS OF USE SERVIER PHARMACEUTICALS LLC 2017-10-26 — — US disclosed
US-20170266193-A1 THERAPEUTICALLY ACTIVE COMPOUNDS AND THEIR METHODS OF USE SERVIER PHARMACEUTICALS LLC 2017-09-21 — — US disclosed
US-9738625-B2 Therapeutically active compounds and their methods of use AGIOS PHARMACEUTICALS, INC. (US) 2017-08-22 — — US disclosed
US-20160194305-A1 THERAPEUTICALLY ACTIVE COMPOUNDS AND THEIR METHODS OF USE SERVIER PHARMACEUTICALS LLC 2016-07-07 — — 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 (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-10201543-B2 Therapeutically active compounds and their methods of use MCL1, TP53, BAK1 IDH2 168/4885IDH1 137/4885ABCB11 3961/4885
US-20170266193-A1 THERAPEUTICALLY ACTIVE COMPOUNDS AND THEIR METHODS OF USE NFATC1, BCL6, MCTS1 IDH2 22/4885IDH1 14/4885ABCB11 4471/4885
US-20180125850-A1 THERAPEUTICALLY ACTIVE COMPOUNDS AND THEIR METHODS OF USE NFATC1, BCL6, MCTS1 IDH2 22/4885IDH1 14/4885ABCB11 4471/4885
US-10093654-B2 Therapeutically active compounds and their methods of use MCL1, TP53, BRDT IDH2 123/4885IDH1 238/4885ABCB11 3369/4885
US-20170305885-A1 THERAPEUTICALLY ACTIVE COMPOUNDS AND THEIR METHODS OF USE MCL1, TP53, BRDT IDH2 123/4885IDH1 238/4885ABCB11 3369/4885
US-10105369-B2 Therapeutically active compounds and their methods of use NFATC1, BCL6, MCTS1 IDH2 22/4885IDH1 14/4885ABCB11 4471/4885
US-20180028539-A1 THERAPEUTICALLY ACTIVE COMPOUNDS AND THEIR METHODS OF USE MCL1, TP53, BAK1 IDH2 168/4885IDH1 137/4885ABCB11 3961/4885
US-20180370951-A1 THERAPEUTICALLY ACTIVE COMPOUNDS AND THEIR METHODS OF USE MCL1, TP53, DLD IDH2 73/4885IDH1 124/4885ABCB11 2959/4885
US-20160194305-A1 THERAPEUTICALLY ACTIVE COMPOUNDS AND THEIR METHODS OF USE IDH2, IDH1, IDH3A IDH2 1/4885IDH1 2/4885ABCB11 1389/4885
US-10730854-B2 Therapeutically active compounds and their methods of use MCL1, TP53, DLD IDH2 73/4885IDH1 124/4885ABCB11 2959/4885

“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.

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