SCHEMBL496444

SCHEMBL496444

c1ccc2c(c1)[N]c1cnccc1-2

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOA P21397 2/20 0.48
MAOB P27338 2/20 0.48
TNF P01375 1/20 0.37
CYP19A1 P11511 2/20 0.34
CYP11B2 P19099 2/20 0.34
RPS6KA3 P51812 2/20 0.33
HTT P42858 1/20 0.33
CDC25B P30305 1/20 0.33
LIMK1 P53667 1/20 0.33
SMN1; SMN2 Q16637 2/20 0.32
ALDH1A1 P00352 2/20 0.32
ACHE P22303 1/20 0.32
NPC1 O15118 1/20 0.32
TP53 P04637 1/20 0.32
MAPT P10636 1/20 0.32
RAB9A P51151 1/20 0.32
MAPK10 P53779 1/20 0.32
KDM4E B2RXH2 1/20 0.32
GABRP O00591 1/20 0.32
GABRD O14764 1/20 0.32

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
SCHEMBL9709542 0.88 MAOA (0.62) MAOAMAOBTNFCYP19A1HTT
SCHEMBL24062 0.80 MEN1 (0.37) MAOAMAOBHTTCDC25BSMN1; SMN2
SCHEMBL27971780 0.77 MEN1 (0.35) MAOAMAOBHTTCDC25BSMN1; SMN2
SCHEMBL27860206 0.77 MEN1 (0.35) MAOAMAOBHTTCDC25BSMN1; SMN2
SCHEMBL9709023 0.75 MAOA (0.62) MAOAMAOBTNFCYP19A1HTT
SCHEMBL28512593 0.72 MAOA (0.65) MAOAMAOBTNFCYP19A1CYP11B2
SCHEMBL19764657 0.72 MAOA (0.65) MAOAMAOBTNFCYP19A1CYP11B2
SCHEMBL14380259 0.72 MAOA (0.65) MAOAMAOBTNFCYP19A1CYP11B2
SCHEMBL27971618 0.70 CYP1A2 (0.31) CDC25BIDO1CYP1A2CYP2D6
SCHEMBL1750489 0.65 MEN1 (0.58) MAOAMAOBHTTCDC25BSMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-RE49118-E1 Material for organic electroluminescence device and electroluminescence device employing the same IDEMITSU KOSAN CO., LTD. (JP) 2022-06-28 US claimed
WO-2016029146-A1 SPECIFIC INHIBITORS OF METHIONYL-TRNA SYNTHETASE UNIVERSITY OF WASHINGTON (US) 2016-02-25 WO claimed
EP-1183252-B1 PHARMACEUTICALLY ACTIVE COMPOUNDS ASTRAZENECA AB (SE) 2004-02-18 EP claimed
US-6492406-B1 PROTEIN KINASE C INHIBITORS; ANTIINFLAMMATORY AND IMMUNO-SUPPRESSIVE AGENTS ASTRAZENECA AB (SE) 2002-12-10 US claimed
EP-0654495-B1 Photoconductive film formed from a grafted silane polymer; process for preparing and process for the formation of an electrostatic image of this film and an optical valve based on this film FRANCE TELECOM (FR) 1999-01-27 EP claimed
EP-0548553-A1 Optically active azole compounds, their production and use Takeda Chemical Industries, Ltd. (JP) 1993-06-30 EP claimed
US-11999741-B2 Process for the synthesis of 6-((3S,4S)-4-methyl-1-(pyrimidin-2-ylmethyl)pyrrolidin-3-yl)-3-(tetrahydropyran-4-yl-7H-imidazo[1,5-a]pyrazin-8-one CARDURION PHARMACEUTICALS, INC. (US) 2024-06-04 US disclosed
EP-3630772-B1 METHODS OF MAKING AND USING PDE9 INHIBITORS IMARA INC (US) 2023-11-01 EP disclosed
US-20230183244-A1 METHODS OF MAKING AND USING PDE9 INHIBITORS CARDURION PHARMACEUTICALS, INC. 2023-06-15 US disclosed
US-11613544-B2 Substituted imidazo[1,5-a]pyrazines for modulation of IRE1 THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2023-03-28 US disclosed
US-RE49118-E1 Material for organic electroluminescence device and electroluminescence device employing the same IDEMITSU KOSAN CO., LTD. (JP) 2022-06-28 US disclosed
US-11370795-B2 Process for the synthesis of 6-[(3S,4S)-4-methyl-1-(pyrimidin-2-ylmethyl)pyrrolidin-3-yl]-3-tetrahydropyran-4-yl-7H-imidazo[1,5-a]pyrazin-8-one Imara Inc. (US) 2022-06-28 US disclosed
US-20220185836-A1 COMPOUNDS, COMPOSITIONS, AND METHODS FOR THE TREATMENT OF CANCERS XLINK THERAPEUTICS INC (US) 2022-06-16 US disclosed
US-5069991-A NAPHTHOLACTAM OR ISINDOLENINE DYE BASF AKTIENGESELLSCHAFT (DE) 1991-12-03 US disclosed
EP-0364890-A2 Panchromatic electrophotographical recording element BASF Aktiengesellschaft (DE) 1990-04-25 EP disclosed
US-4906541-A Electrophotographic recording element containing a naphtholactam dye sensitizer BASF AKTIENGESELLSCHAFT (DE) 1990-03-06 US disclosed
US-4451462-A Method of treating inflammation and pain using heteramino benzofurans CIBA-GEIGY CORPORATION (US) 1984-05-29 US disclosed
US-4426380-A ANTIINFLAMMATORY, ANALGESIC, SUNSCREEN CIBA-GEIGY CORPORATION (US) 1984-01-17 US disclosed
EP-0082109-A2 Substituted 2-hydroxyphenylacetic acids and derivatives of them CIBA-GEIGY AG (CH) 1983-06-22 EP disclosed
EP-0078241-A2 Furanes CIBA-GEIGY AG (CH) 1983-05-04 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 (5 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-20220185836-A1 COMPOUNDS, COMPOSITIONS, AND METHODS FOR THE TREATMENT OF CANCERS TP53, VHL, KRAS MAOA 4293/4885MAOB 3510/4885TNF 4546/4885
US-11999741-B2 Process for the synthesis of 6-((3S,4S)-4-methyl-1-(pyrimidin-2-ylmethyl)pyrrolidin-3-yl)-3-(tetrahydropyran-4-yl-7H-imidazo[1,5-a]pyrazin-8-one CDK8, PRMT8, RPS8 MAOA 893/4885MAOB 1546/4885TNF 4181/4885
US-11613544-B2 Substituted imidazo[1,5-a]pyrazines for modulation of IRE1 XBP1, HSPA5, ATF4 MAOA 4665/4885MAOB 4775/4885TNF 4090/4885
US-20230183244-A1 METHODS OF MAKING AND USING PDE9 INHIBITORS PDE9A, PDE4B, PDE12 MAOA 1197/4885MAOB 828/4885TNF 1580/4885
US-11370795-B2 Process for the synthesis of 6-[(3S,4S)-4-methyl-1-(pyrimidin-2-ylmethyl)pyrrolidin-3-yl]-3-tetrahydropyran-4-yl-7H-imidazo[1,5-a]pyrazin-8-one TYMS, TKT, TPMT MAOA 1439/4885MAOB 2349/4885TNF 1332/4885

“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.