SCHEMBL18557014

SCHEMBL18557014

Clc1nc(Cl)nc(C2CCCCCCC2)n1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDE10A Q9Y233 6/20 0.43
NPC1 O15118 1/20 0.41
RAB9A P51151 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
ALDH1A1 P00352 2/20 0.40
ALOX15 P16050 1/20 0.40
TSHR P16473 1/20 0.40
CHRM3 P20309 7/20 0.37
PDE4A P27815 6/20 0.37
PDE4B Q07343 5/20 0.37
PDE4C Q08493 5/20 0.37
PDE4D Q08499 5/20 0.37
POLB P06746 1/20 0.35
CASP3 P42574 1/20 0.35
SENP7 Q9BQF6 1/20 0.35
SENP6 Q9GZR1 1/20 0.35
PDE5A O76074 1/20 0.35
KDM4E B2RXH2 1/20 0.34
HPGD P15428 1/20 0.34
HSD17B10 Q99714 1/20 0.34

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
SCHEMBL17814294 1.00 PDE10A (0.43) PDE10ANPC1RAB9ASMN1; SMN2ALDH1A1
SCHEMBL18557023 1.00 PDE10A (0.43) PDE10ANPC1RAB9ASMN1; SMN2ALDH1A1
SCHEMBL21573348 1.00 PDE10A (0.43) PDE10ANPC1RAB9ASMN1; SMN2ALDH1A1
SCHEMBL18520714 1.00 PDE10A (0.43) PDE10ANPC1RAB9ASMN1; SMN2ALDH1A1
SCHEMBL18520713 1.00 PDE10A (0.43) PDE10ANPC1RAB9ASMN1; SMN2ALDH1A1
SCHEMBL18520712 1.00 PDE10A (0.43) PDE10ANPC1RAB9ASMN1; SMN2ALDH1A1
SCHEMBL16388486 1.00 PDE10A (0.43) PDE10ANPC1RAB9ASMN1; SMN2ALDH1A1
SCHEMBL17486092 0.95 PDE10A (0.43) PDE10ANPC1RAB9ASMN1; SMN2ALDH1A1
SCHEMBL22041445 0.95 PDE10A (0.43) PDE10ANPC1RAB9ASMN1; SMN2ALDH1A1
SCHEMBL19679967 0.95 PDE10A (0.43) PDE10ANPC1RAB9ASMN1; SMN2ALDH1A1

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
US-20230250078-A1 THERAPEUTICALLY ACTIVE COMPOUNDS AND THEIR METHODS OF USE SERVIER PHARMACEUTICALS LLC (US) 2023-08-10 US disclosed
EP-3984997-A1 THERAPEUTICALLY ACTIVE COMPOUNDS AND THEIR METHODS OF USE Les Laboratoires Servier SAS (FR) 2022-04-20 EP disclosed
EP-3019484-B1 THERAPEUTICALLY ACTIVE COMPOUNDS AND THEIR METHODS OF USE LES LABORATOIRES SERVIER SAS (FR) 2021-09-08 EP 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-3019490-B1 N,6-BIS(ARYL OR HETEROARYL)-1,3,5-TRIAZINE-2,4-DIAMINE COMPOUNDS AS IDH2 MUTANTS INHIBITORS FOR THE TREATMENT OF CANCER AGIOS PHARMACEUTICALS INC (US) 2020-06-03 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-10017495-B2 Therapeutically active compounds and their methods of use AGIOS PHARMACEUTICALS, INC. (US) 2018-07-10 US disclosed
EP-2800743-B1 THERAPEUTICALLY ACTIVE COMPOUNDS AND THEIR METHODS OF USE AGIOS PHARMACEUTICALS INC (US) 2018-04-04 EP disclosed
US-9732062-B2 Therapeutically active compounds and their methods of use AGIOS PHARMACEUTICALS, INC. (US) 2017-08-15 US disclosed
US-9724350-B2 N,6-bis(aryl or heteroaryl)-1,3,5-triazine-2,4-diamine compounds as IDH2 mutants inhibitors for the treatment of cancer AGIOS PHARMACEUTICALS, INC. (US) 2017-08-08 US disclosed
US-20170107194-A1 THERAPEUTICALLY ACTIVE COMPOUNDS AND THEIR METHODS OF USE SERVIER PHARMACEUTICALS LLC 2017-04-20 US disclosed
US-9579324-B2 Therapeutically active compounds and their methods of use AGIOS PHARMACEUTICALS, INC (US) 2017-02-28 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 (7 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 PDE10A 2875/4885NPC1 513/4885RAB9A 1818/4885
US-10017495-B2 Therapeutically active compounds and their methods of use MCL1, TP53, BRDT PDE10A 2875/4885NPC1 513/4885RAB9A 1818/4885
US-20230250078-A1 THERAPEUTICALLY ACTIVE COMPOUNDS AND THEIR METHODS OF USE MCL1, TP53, BRDT PDE10A 2875/4885NPC1 513/4885RAB9A 1818/4885
US-10028961-B2 Therapeutically active compounds and their methods of use MCL1, TP53, BRDT PDE10A 2875/4885NPC1 513/4885RAB9A 1818/4885
US-10172864-B2 Therapeutically active compounds and their methods of use MCL1, TP53, BRDT PDE10A 2875/4885NPC1 513/4885RAB9A 1818/4885
US-10946023-B2 Therapeutically active compounds and their methods of use MCL1, TP53, BRDT PDE10A 2875/4885NPC1 513/4885RAB9A 1818/4885
US-20170107194-A1 THERAPEUTICALLY ACTIVE COMPOUNDS AND THEIR METHODS OF USE MCL1, TP53, BRDT PDE10A 2875/4885NPC1 513/4885RAB9A 1818/4885

“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.