SCHEMBL4810183

SCHEMBL4810183

CCCc1cc(=O)n(-c2ccccc2)[nH]1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.58
KDM4E B2RXH2 5/20 0.56
ALDH1A1 P00352 6/20 0.53
MAPT P10636 5/20 0.53
LMNA P02545 2/20 0.53
POLB P06746 1/20 0.53
BLM P54132 1/20 0.53
ATM Q13315 1/20 0.53
L3MBTL1 Q9Y468 1/20 0.53
KDM5A P29375 1/20 0.52
KDM2B Q8NHM5 1/20 0.52
KDM4C Q9H3R0 1/20 0.52
KDM5B Q9UGL1 1/20 0.52
CLK4 Q9HAZ1 1/20 0.50
SMN1; SMN2 Q16637 4/20 0.43
HPGD P15428 2/20 0.43
RAB9A P51151 2/20 0.43
HSD17B10 Q99714 2/20 0.43
MAPK10 P53779 1/20 0.43
GAA P10253 4/20 0.42

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
SCHEMBL23403253 0.90 TSHR (0.56) TSHRKDM4EALDH1A1MAPTLMNA
SCHEMBL7518997 0.89 TSHR (0.55) TSHRKDM4EALDH1A1MAPTLMNA
SCHEMBL11199820 0.88 TSHR (0.53) TSHRKDM4EALDH1A1MAPTLMNA
SCHEMBL486186 0.86 TSHR (0.61) TSHRKDM4EALDH1A1MAPTLMNA
SCHEMBL5976258 0.85 KDM4E (0.48) TSHRKDM4EALDH1A1MAPTLMNA
SCHEMBL5975036 0.84 ALKBH5 (0.56) TSHRKDM4EALDH1A1MAPTLMNA
SCHEMBL5977431 0.84 KDM4E (0.48) TSHRKDM4EMAPTLMNAKDM5A
SCHEMBL5975722 0.84 KDM4E (0.47) TSHRKDM4EALDH1A1MAPTLMNA
SCHEMBL5976501 0.84 ALKBH5 (0.51) TSHRKDM4EALDH1A1MAPTLMNA
SCHEMBL5975781 0.84 ALKBH5 (0.51) TSHRKDM4EALDH1A1MAPTLMNA

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-RE35801-E PYRAZOLONE DERIVATIVES MITSUBISHI CHEMICAL CORPORATION (JP) 1998-05-19 US claimed
US-4857542-A INHIBITOR AGAINST LIPID PEROXIDATION MITSUBISHI CHEMICAL INDUSTRIES LIMITED (JP) 1989-08-15 US claimed
EP-3828159-A1 STORAGE AND TRANSPORT STABILIZERS FOR POLYMERIZABLE COMPOUNDS BASF SE (DE) 2021-06-02 EP disclosed
CN-108997365-B Series catalytic preparation method of chiral pyrazole spirofuran compound 浙江工业大学 2021-04-06 CN disclosed
US-7368224-B2 High photosensitivity, visible laser recording materials; comprised of novel squarylium compound metal complexes, free radical generators and monomers KYOWA HAKKO CHEMICAL CO., LTD. (JP) 2008-05-06 US disclosed
EP-1334998-B1 METAL COMPLEX TYPE SQUARYLIUM COMPOUNDS AND OPTICAL RECORDING MEDIA MADE BY USING THE SAME KYOWA HAKKO CHEMICAL CO LTD (JP) 2006-08-02 EP disclosed
US-20050164120-A1 Photopolymerizable composition KYOWA HAKKO CHEMICAL CO., LTD. (JP) 2005-07-28 US disclosed
EP-1493757-A1 PHOTOPOLYMERIZABLE COMPOSITION Kyowa Hakko Chemical Co., Ltd. (JP) 2005-01-05 EP disclosed
US-6660867-B2 Squarylium compounds having spectroscopic properties, light resistance, solubility and thermal decomposition properties suitable for a recording material for DVD-R, and optical recording media using the same KYOWA HAKKO KOGYO CO., LTD. (JP) 2003-12-09 US disclosed
US-20030187272-A1 Metal complex type squarylium compounds and optical recording media made by using the same KYOWA HAKKO CHEMICAL CO., LTD. (FORMERLY KYOWA YUKA CO., LTD.) (JP) 2003-10-02 US disclosed
EP-1334998-A1 METAL COMPLEX TYPE SQUARYLIUM COMPOUNDS AND OPTICAL RECORDING MEDIA MADE BY USING THE SAME KYOWA HAKKO KOGYO CO., LTD. (JP) 2003-08-13 EP disclosed
US-4761484-A PREFERENTIAL EXTRACTION OF COPPER FROM MINERAL CONCENTRATES SOCIETE NATIONALE DES POUDRES ET EXPLOSIFS (FR) 1988-08-02 US disclosed
EP-0129448-B1 PROCESS FOR SELECTIVELY EXTRACTING COPPER USING 4-ACYL(3H)-PYRAZOL-3-ONES SOCIETE NATIONALE DES POUDRES ET EXPLOSIFS (FR) 1988-02-10 EP disclosed
US-4666513-A Process for the selective extraction of copper using 4-acyl-(3H)-pyrazol-3-ones SOCIETE NATIONALE DES POUDRES ET EXPLOSIFS (FR) 1987-05-19 US disclosed
US-4146540-A Pyrazole compounds as stabilizers for organic materials SANDOZ LTD. (CH) 1979-03-27 US disclosed
US-4008200-A Method of stabilizing organic materials employing pyrazole compounds and stabilized compositions thereof SANDOZ LTD. (CH) 1977-02-15 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-20030187272-A1 Metal complex type squarylium compounds and optical recording media made by using the same DCLK2, DCLK3, DCLK1 TSHR 4474/4885KDM4E 1359/4885ALDH1A1 2113/4885

“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.