SCHEMBL895544

SCHEMBL895544

NCc1cccc2cccnc12

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MMP2 P08253 2/20 0.54
TSHR P16473 2/20 0.54
HTT P42858 2/20 0.54
LMNA P02545 2/20 0.54
KDM4E B2RXH2 2/20 0.54
MAPT P10636 2/20 0.54
CYP3A4 P08684 2/20 0.54
GMNN O75496 1/20 0.54
TP53 P04637 1/20 0.54
HSP90AA1 P07900 1/20 0.54
CYP2D6 P10635 1/20 0.54
MMP9 P14780 1/20 0.54
ALOX15 P16050 1/20 0.54
NFKB1 P19838 1/20 0.54
MMP8 P22894 1/20 0.54
CCR1 P32246 1/20 0.54
THPO P40225 1/20 0.54
MTOR P42345 1/20 0.54
MMP13 P45452 1/20 0.54
CCR5 P51681 1/20 0.54

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
Water SCHEMBL15271605 0.98 MMP2 (0.52) MMP2TSHRHTTLMNAKDM4E
Hydrochloric Acid SCHEMBL16899244 0.98 MMP2 (0.52) MMP2TSHRHTTLMNAKDM4E
Ether SCHEMBL15271604 0.88 KMT2A (0.43) MMP2TSHRHTTLMNAKDM4E
SCHEMBL28067810 0.85 LMNA (0.45) MMP2TSHRHTTLMNAKDM4E
SCHEMBL6222571 0.84 LMNA (0.50) MMP2TSHRHTTLMNAKDM4E
SCHEMBL5307234 0.81 P2RX7 (0.47) MMP2TSHRHTTLMNAKDM4E
SCHEMBL11973482 0.80 LMNA (0.56) MMP2TSHRHTTLMNAKDM4E
SCHEMBL11497743 0.80 NPC1 (0.47) MMP2TSHRHTTLMNAKDM4E
SCHEMBL7344355 0.79 KDM4E (0.54) MMP2TSHRHTTLMNAKDM4E
SCHEMBL19303228 0.79 KDM4E (0.54) MMP2TSHRHTTLMNAKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2023130701-A1 1-AMINOBENZO[4,5]IMIDAZO[1,2-A]PYRAZINE-3-FORMAMIDE COMPOUND, AND PREPARATION THEREFOR AND USE THEREOF 中山大学 2023-07-13 WO claimed
CN-114276354-A 1-aminobenzo [4,5] imidazo [1,2-a ] pyrazine-3-formamide compound and preparation and application thereof 中山大学 2022-04-05 CN claimed
CN-105601565-B A kind of preparation method of the polyisocyanates of the biuret-containing structure of stable storage 万华化学集团股份有限公司 2018-05-15 CN claimed
US-9737875-B2 Affinity reagents for protein purification IMPOSSIBLE FOODS INC. (US) 2017-08-22 US claimed
CN-105601565-A Method for preparing polyisocyanate containing biuret structure with stable storage WANHUA CHEMICAL GROUP CO LTD 2016-05-25 CN claimed
EP-0675111-A2 Process for the preparation of 6-hydroxymethyl-quinolines BASF AKTIENGESELLSCHAFT (DE) 1995-10-04 EP claimed
US-20250346563-A1 HISTONE DEACETYLASE 6 INHIBITORS AND METHOD FOR TREATING NEUROPATHIC PAIN UNIV TAIPEI MEDICAL (TW) 2025-11-13 US disclosed
CN-118620179-A Storage-stable biuret polyisocyanate composition and preparation method thereof 万华化学集团股份有限公司 2024-09-10 CN disclosed
WO-2024086132-A1 PROTACS TARGETING VIRAL ENZYMES FOR PRECISE TREATMENT OF COVID-19 OHIO UNIVERSITY (US) 2024-04-25 WO disclosed
CN-117887037-A Biuret polyisocyanate composition and preparation method thereof 万华化学(宁波)有限公司 2024-04-16 CN disclosed
CN-117683205-A Biuret polyisocyanate composition and preparation method thereof 万华化学(宁波)有限公司 2024-03-12 CN disclosed
EP-3969446-B1 COMPOUNDS FOR TREATING HUNTINGTON'S DISEASE PTC THERAPEUTICS INC (US) 2023-09-27 EP disclosed
EP-3573960-B1 N-{[2-(PIPERIDIN-1-YL)PHENYL](PHENYL)METHYL}-2-(3-OXO-3,4-DIHYDRO-2H-1,4-BENZOXAZIN-7-YL)ACETAMIDE DERIVATIVES AND RELATED COMPOUNDS AS ROR-GAMMA MODULATORS FOR TREATING AUTOIMMUNE DISEASES GENFIT (FR) 2023-08-16 EP disclosed
EP-0675111-A2 Process for the preparation of 6-hydroxymethyl-quinolines BASF AKTIENGESELLSCHAFT (DE) 1995-10-04 EP disclosed
EP-0675111-A2 Process for the preparation of 6-hydroxymethyl-quinolines BASF AKTIENGESELLSCHAFT (DE) 1995-10-04 EP disclosed
US-5395838-A Aromatic aminomethyl substitutes compounds IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1995-03-07 US disclosed
EP-0373891-B1 Anti-tumour agents ICI PLC (GB) 1994-11-02 EP disclosed
US-5252573-A Quinazoline derivatives IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1993-10-12 US disclosed
US-5089499-A Anticarcinogenic agents; thymidylate synthetase inhibitors; antiallergens; psoriasis IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1992-02-18 US disclosed
EP-0373891-A2 Anti-tumour agents IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1990-06-20 EP 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 (1 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-20250346563-A1 HISTONE DEACETYLASE 6 INHIBITORS AND METHOD FOR TREATING NEUROPATHIC PAIN HDAC1, HDAC3, HDAC5 MMP2 167/4885TSHR 4209/4885HTT 1141/4885

“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.