SCHEMBL1344359

SCHEMBL1344359

COc1cc(I)cc(C(F)(F)F)c1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RXRA P19793 1/20 0.42
RXRB P28702 1/20 0.42
RXRG P48443 1/20 0.42
ALDH1A1 P00352 1/20 0.40
PTGS1 P23219 1/20 0.39
L3MBTL1 Q9Y468 2/20 0.38
RAB9A P51151 2/20 0.38
HDAC3 O15379 1/20 0.38
HDAC1 Q13547 1/20 0.38
HDAC2 Q92769 1/20 0.38
HDAC6 Q9UBN7 1/20 0.38
TMPRSS4 Q9NRS4 2/20 0.37
EPHX2 P34913 1/20 0.37
KDM1A O60341 1/20 0.37
TLR8 Q9NR97 1/20 0.35
MAPT P10636 2/20 0.35
NPSR1 Q6W5P4 1/20 0.35
P2RX1 P51575 1/20 0.35
CYP1A2 P05177 1/20 0.35
CYP3A4 P08684 1/20 0.35

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
SCHEMBL30074463 1.00 RXRA (0.42) RXRARXRBRXRGALDH1A1PTGS1
SCHEMBL5782136 0.84 ALDH1A1 (0.58) RXRARXRBRXRGALDH1A1PTGS1
SCHEMBL679095 0.84 ALDH1A1 (0.50) RXRARXRBRXRGALDH1A1PTGS1
SCHEMBL20844170 0.81 CA1 (0.42) ALDH1A1RAB9AMAPTCYP3A4KDM4E
SCHEMBL16094031 0.78 HTT (0.42) ALDH1A1L3MBTL1TLR8KDM4EKMT2A
SCHEMBL2522090 0.77 RXRA (0.43) RXRARXRBRXRGALDH1A1PTGS1
SCHEMBL257565 0.77 RXRA (0.43) RXRARXRBRXRGALDH1A1PTGS1
SCHEMBL12255396 0.77 RXRA (0.43) RXRARXRBRXRGALDH1A1PTGS1
SCHEMBL30181252 0.77 RXRA (0.43) RXRARXRBRXRGALDH1A1PTGS1
SCHEMBL388181 0.77 ALDH1A1 (0.69) ALDH1A1CYP1A2CYP3A4CYP2D6CYP2C19

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4570313-A2 CYANOTRIAZOLE COMPOUNDS Otsuka Pharmaceutical Co., Ltd. (JP) 2025-06-18 EP disclosed
US-20240246969-A1 HETEROCYCLIC DERIVATIVES AS CAMKK2 INHIBITORS BRISTOL-MYERS SQUIBB COMPANY 2024-07-25 US disclosed
EP-4337660-A1 HETEROCYCLIC DERIVATIVES AS CAMKK2 INHIBITORS Bristol-Myers Squibb Company (US) 2024-03-20 EP disclosed
CN-117597345-A Heterocyclic derivatives as CaMKK2 inhibitors 百时美施贵宝公司 2024-02-23 CN disclosed
EP-4219477-A1 CYANOTRIAZOLE COMPOUNDS Otsuka Pharmaceutical Co., Ltd. (JP) 2023-08-02 EP disclosed
US-10626095-B2 Cyanotriazole compounds OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2020-04-21 US disclosed
US-20160229816-A1 CYANOTRIAZOLE COMPOUNDS OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2016-08-11 US disclosed
EP-1737811-B1 CETP INHIBITORS MERCK SHARP & DOHME (US) 2016-08-10 EP disclosed
EP-3022199-A1 CYANOTRIAZOLE COMPOUNDS Otsuka Pharmaceutical Co., Ltd. (JP) 2016-05-25 EP disclosed
US-8975400-B2 2,3-dihydroimidazo[1, 2-c] pyrimidin-5(1 H)-one compounds use as LP-PLA2 inhibitors GLAXO GROUP LIMITED (GB) 2015-03-10 US disclosed
US-20080249090-A1 Substituted pyridone compounds and methods of use AMGEN INC. (US) 2008-10-09 US disclosed
US-20080249090-A1 Substituted pyridone compounds and methods of use AMGEN INC. (US) 2008-10-09 US disclosed
WO-2008011109-A2 SUBSTITUTED PYRIDONE COMPOUNDS AND METHODS OF USE AMGEN INC. (US) 2008-01-24 WO disclosed
WO-2008011109-A2 SUBSTITUTED PYRIDONE COMPOUNDS AND METHODS OF USE AMGEN INC. (US) 2008-01-24 WO disclosed
US-20070225365-A1 Cetp Inhibitors MERCK & CO., INC. (US) 2007-09-27 US disclosed
CN-1942428-A CETP inhibitors MERCK & CO INC (US) 2007-04-04 CN disclosed
EP-1737811-A1 CETP INHIBITORS Merck & Co., Inc. (US) 2007-01-03 EP disclosed
WO-2005100298-A1 CETP INHIBITORS MERCK & CO., INC. (US) 2005-10-27 WO disclosed
US-5196422-A Antiinflammatory agents, antiallergens ICI PHARMA (FR) 1993-03-23 US disclosed
US-5089513-A Antiinflammatory agents; antiallergens; asthma; side effect reduction ICI PHARMA (FR) 1992-02-18 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 (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-10626095-B2 Cyanotriazole compounds CS, PC, ACAT1 RXRA 3077/4885RXRB 2771/4885RXRG 3206/4885
US-20070225365-A1 Cetp Inhibitors CETP, APOB, NPC1 RXRA 2001/4885RXRB 2413/4885RXRG 1901/4885
US-20240246969-A1 HETEROCYCLIC DERIVATIVES AS CAMKK2 INHIBITORS CAMKK2, CAMKK1, CAMK1 RXRA 3375/4885RXRB 3262/4885RXRG 2568/4885
US-20080249090-A1 Substituted pyridone compounds and methods of use KIT, CMA1, C3AR1 RXRA 3094/4885RXRB 2442/4885RXRG 2721/4885
US-20160229816-A1 CYANOTRIAZOLE COMPOUNDS CS, PC, ACAT1 RXRA 3077/4885RXRB 2771/4885RXRG 3206/4885

“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.