SCHEMBL2581169

SCHEMBL2581169

CC1(C)[CH]c2ccccc2C1

nearest known ligand 0.39

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
MAOB P27338 2/20 0.33
HTR2A P28223 1/20 0.33
KMT2A Q03164 2/20 0.31
TSHR P16473 1/20 0.31
NOTUM Q6P988 1/20 0.31
ALDH1A1 P00352 1/20 0.31
HTR5A P47898 1/20 0.31

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
SCHEMBL29174116 0.98 MAOB (0.32) MAOBHTR2AKMT2ANOTUMALDH1A1
SCHEMBL28990007 0.92 NOTUM (0.31) NOTUM
SCHEMBL28990003 0.92 ALDH1A1 (0.31) KMT2AALDH1A1
SCHEMBL7883341 0.77 MAOB (0.39) MAOBHTR2ATSHRNOTUMALDH1A1
SCHEMBL1697644 0.77 PARP1 (0.36) MAOBHTR2AKMT2AALDH1A1
SCHEMBL9530955 0.74 KMT2A (0.38) HTR2AKMT2ATSHRALDH1A1
SCHEMBL9532397 0.73 NPSR1 (0.37) MAOBHTR2AKMT2ATSHRALDH1A1
SCHEMBL9533537 0.71 TSHR (0.31) TSHR
SCHEMBL9531388 0.71 ALOX12 (0.36) MAOBHTR2AKMT2A
SCHEMBL9532066 0.70 ALOX12 (0.34) MAOBKMT2AALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0876366-B1 ANGIOGENESIS INHIBITING PYRIDAZINAMINES JANSSEN PHARMACEUTICA NV (BE) 2001-07-25 EP claimed
US-5985878-A Angiogenesis inhibiting pyridazinamines JANSSEN PHARMACEUTICALS, N.V. (BE) 1999-11-16 US claimed
EP-0876366-A2 ANGIOGENESIS INHIBITING PYRIDAZINAMINES JANSSEN PHARMACEUTICA N.V. (BE) 1998-11-11 EP claimed
WO-1997026258-A1 ANGIOGENESIS INHIBITING PYRIDAZINAMINES JANSSEN PHARMACEUTICA N.V. (BE) 1997-07-24 WO claimed
EP-0277384-A2 1H-imidazole-5-carboxylic acid derivatives JANSSEN PHARMACEUTICA N.V. (BE) 1988-08-10 EP claimed
EP-2763528-A1 PESTICIDE PREPARATION AND PROCESS FOR PRODUCING THE SAME Bayer Intellectual Property GmbH (DE) 2014-08-13 EP disclosed
US-8586611-B2 Fungicidal carboxamides E. I. DU PONT DE NEMOURS AND COMPANY (US) 2013-11-19 US disclosed
EP-1948649-B1 FUNGICIDAL CARBOXAMIDES DU PONT (US) 2013-06-26 EP disclosed
WO-2013050433-A1 PESTICIDE PREPARATION AND PROCESS FOR PRODUCING THE SAME BAYER INTELLECTUAL PROPERTY GMBH (DE) 2013-04-11 WO disclosed
CN-101501083-B Method for preparing high viscosity fluid EXXON MOBIL CHEM PATENTS INC 2012-12-05 CN disclosed
US-20110269712-A1 Fungicidal Carboxamides BISAHA JOHN JOSEPH 2011-11-03 US disclosed
CN-101522647-A Substituted azolin-2-yl-amino compounds BASF AG (DE) 2009-09-02 CN disclosed
EP-0314852-B1 Process for the preparation of 1-substituted imidazole-carbonic acid and derivatives CIBA GEIGY AG (CH) 1993-11-18 EP disclosed
US-5135927-A 2-chloro-4-trifluoromethylthiazol-5-carboxylic acid CIBA-GEIGY CORPORATION (US) 1992-08-04 US disclosed
US-4992434-A Prevention of infestation of plants by phytopathogenic microorganisms CIBA-GEIGY CORPORATION (US) 1991-02-12 US disclosed
US-4921955-A Process for the synthesis of 1-substituted imidazole-5-carboxylic acids and carboxylic acid derivatives CIBA-GEIGY CORPORATION (US) 1990-05-01 US disclosed
EP-0314852-A2 Process for the preparation of 1-substituted imidazole-carbonic acid and derivatives CIBA-GEIGY AG (CH) 1989-05-10 EP disclosed
EP-0277384-A2 1H-imidazole-5-carboxylic acid derivatives JANSSEN PHARMACEUTICA N.V. (BE) 1988-08-10 EP disclosed
US-4076726-A Amidino-hydrazone derivatives AKZONA INCORPORATED (US) 1978-02-28 US disclosed
US-4028380-A Hydrazino-imidazole derivatives AKZONA INCORPORATED (US) 1977-06-07 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 (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-20110269712-A1 Fungicidal Carboxamides NAT1, PFAS, CHRM1 MAOB 2045/4885HTR2A 2824/4885KMT2A 404/4885

“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.