SCHEMBL662800

SCHEMBL662800

CC(C)(C)c1ncc(Br)cn1

nearest known ligand 0.38

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.38
HTT P42858 1/20 0.32
KMT2A Q03164 1/20 0.32
GBA1 P04062 1/20 0.31
ALDH1A1 P00352 1/20 0.31
HPGD P15428 1/20 0.30

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
SCHEMBL1404057 0.79 KDM4E (0.35) KDM4EHTTKMT2AALDH1A1
SCHEMBL16416035 0.79 KDM4E (0.35) KDM4EHTTKMT2A
SCHEMBL16793357 0.79 KDM4E (0.40) KDM4EHTTKMT2A
SCHEMBL16793394 0.79 KDM4E (0.35) KDM4EHTTKMT2A
Hydrochloric Acid SCHEMBL20569582 0.77 KDM4E (0.39) KDM4EHTTKMT2A
SCHEMBL18015406 0.77 NPC1 (0.38) KDM4EGBA1ALDH1A1
SCHEMBL17654238 0.75 KDM4E (0.33) KDM4EGBA1
SCHEMBL18612517 0.75 GBA1 (0.35) KDM4EGBA1
SCHEMBL7604249 0.74 APLNR (0.41)
SCHEMBL1169515 0.74 HTT (0.35) KDM4EHTTKMT2AALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0117883-B1 PREPARATION OF 2-T-BUTYL-5-HYDROXYPYRIMIDINE BY HYDROLYSIS OF 2-T-BUTYL-5--BROMO/CHLOROPYRIMIDINE THE DOW CHEMICAL COMPANY (US) 1987-01-28 EP claimed
US-4474958-A 2-Alkyl-5-halopyrimidines THE DOW CHEMICAL COMPANY (US) 1984-10-02 US claimed
EP-0117883-A1 Preparation of 2-t-butyl-5-hydroxypyrimidine by hydrolysis of 2-t-butyl-5--bromo/chloropyrimidine THE DOW CHEMICAL COMPANY (US) 1984-09-12 EP claimed
EP-0097451-A1 2-Alkyl-5-pyrimidines THE DOW CHEMICAL COMPANY (US) 1984-01-04 EP claimed
US-4379930-A CATALYTIC HYDROLYSIS OF 2-T-BUTYL-5-PYRIMIDINE USING DIBUTYL DISULFIDE, ELEMENTAL SULFUR AND 2-PICOLINE-N-OXIDE AS CATALYST SYSTEM THE DOW CHEMICAL COMPANY (US) 1983-04-12 US claimed
US-20250388543-A1 HETEROARYL COMPOUNDS FOR THE TREATMENT OF PAIN VERTEX PHARMACEUTICALS INCORPORATED (US) 2025-12-25 US disclosed
US-12503439-B2 Heteroaryl compounds for the treatment of pain VERTEX PHARMACEUTICALS INCORPORATED (US) 2025-12-23 US disclosed
US-20250361236-A9 DIACYLGLYCEROL KINASE MODULATING COMPOUNDS GILEAD SCIENCES INC (US) 2025-11-27 US disclosed
US-20250333406-A1 SULFONYL CYCLIC DERIVATIVES, AND COMPOSITIONS AND METHODS THEREOF LYSOWAY THERAPEUTICS INC (US) 2025-10-30 US disclosed
EP-3351533-B1 BIARYL DERIVATIVE AND MEDICINE CONTAINING SAME KAKEN PHARMA CO LTD (JP) 2025-07-23 EP disclosed
CN-119677737-A Heteroaryl compounds for the treatment of pain 沃泰克斯药物股份有限公司 2025-03-21 CN disclosed
CN-119546580-A Heteroaryl compounds for the treatment of pain 沃泰克斯药物股份有限公司 2025-02-28 CN disclosed
US-4661488-A Pyrimidine substituted-2,2-dimethylcyclopropane carboxylates useful for combating insect and acarine pests at a locus IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1987-04-28 US disclosed
EP-0117883-B1 PREPARATION OF 2-T-BUTYL-5-HYDROXYPYRIMIDINE BY HYDROLYSIS OF 2-T-BUTYL-5--BROMO/CHLOROPYRIMIDINE THE DOW CHEMICAL COMPANY (US) 1987-01-28 EP disclosed
EP-0162538-A2 Cyclopropane derivates IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1985-11-27 EP disclosed
EP-0139477-A2 Process for preparing 5-substituted pyrimidines ELI LILLY AND COMPANY (US) 1985-05-02 EP disclosed
US-4474958-A 2-Alkyl-5-halopyrimidines THE DOW CHEMICAL COMPANY (US) 1984-10-02 US disclosed
EP-0117883-A1 Preparation of 2-t-butyl-5-hydroxypyrimidine by hydrolysis of 2-t-butyl-5--bromo/chloropyrimidine THE DOW CHEMICAL COMPANY (US) 1984-09-12 EP disclosed
EP-0097451-A1 2-Alkyl-5-pyrimidines THE DOW CHEMICAL COMPANY (US) 1984-01-04 EP disclosed
US-4379930-A CATALYTIC HYDROLYSIS OF 2-T-BUTYL-5-PYRIMIDINE USING DIBUTYL DISULFIDE, ELEMENTAL SULFUR AND 2-PICOLINE-N-OXIDE AS CATALYST SYSTEM THE DOW CHEMICAL COMPANY (US) 1983-04-12 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 (4 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-20250388543-A1 HETEROARYL COMPOUNDS FOR THE TREATMENT OF PAIN SCN8A, SCN1B, SCN3A KDM4E 4442/4885HTT 2180/4885KMT2A 3307/4885
US-12503439-B2 Heteroaryl compounds for the treatment of pain TRPV1, SCN3A, KCNN3 KDM4E 4346/4885HTT 348/4885KMT2A 3649/4885
US-20250361236-A9 DIACYLGLYCEROL KINASE MODULATING COMPOUNDS DGKG, DGKB, DGKK KDM4E 1748/4885HTT 4827/4885KMT2A 2566/4885
US-20250333406-A1 SULFONYL CYCLIC DERIVATIVES, AND COMPOSITIONS AND METHODS THEREOF STOML2, ATP2A3, ATP2A1 KDM4E 3136/4885HTT 866/4885KMT2A 3406/4885

“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.