SCHEMBL148905

SCHEMBL148905

[CH2]Cc1ccccc1C(F)(F)F

nearest known ligand 0.55

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
IDO1 P14902 2/20 0.55
ALDH1A1 P00352 3/20 0.46
KDM4E B2RXH2 2/20 0.46
ATM Q13315 1/20 0.46
POLB P06746 2/20 0.43
TDP1 Q9NUW8 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
KMT2A Q03164 1/20 0.43
MAOB P27338 4/20 0.42
POLQ O75417 1/20 0.42
DAO P14920 1/20 0.41
SLC6A2 P23975 1/20 0.40
SLC6A4 P31645 1/20 0.40
AR P10275 1/20 0.40
MAOA P21397 1/20 0.40
NPSR1 Q6W5P4 1/20 0.40

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
SCHEMBL838892 0.82 IDO1 (0.52) IDO1ALDH1A1KDM4EATMPOLB
SCHEMBL5417376 0.82 IDO1 (0.38) IDO1ALDH1A1KDM4EATMPOLB
SCHEMBL5206144 0.81 IDO1 (0.55) IDO1ALDH1A1KDM4EATMPOLB
SCHEMBL3238101 0.80 IDO1 (0.41) IDO1ALDH1A1KDM4EATMPOLB
SCHEMBL150130 0.80 IDO1 (0.46) IDO1ALDH1A1KDM4EATMPOLB
SCHEMBL3647884 0.80 IDO1 (0.59) IDO1ALDH1A1KDM4EATMPOLB
SCHEMBL17329111 0.80 IDO1 (0.59) IDO1ALDH1A1KDM4EATMPOLB
SCHEMBL18305266 0.79 IDO1 (0.40) IDO1ALDH1A1KDM4EATMPOLB
SCHEMBL7504635 0.79 IDO1 (0.48) IDO1ALDH1A1KDM4EATMPOLB
SCHEMBL29129467 0.79 P2RX7 (0.44) IDO1SLC6A2SLC6A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-112867706-A MASP-2 inhibitors and methods of use 奥默罗斯公司 2021-05-28 CN claimed
EP-3802489-A2 MASP-2 INHIBITORS AND METHODS OF USE Omeros Corporation (US) 2021-04-14 EP claimed
EP-3169674-B1 ARYL-TRIAZOLYL-PYRIDINES AS PESTICIDES BAYER ANIMAL HEALTH GMBH (DE) 2021-01-20 EP claimed
US-10299478-B2 Pyrazolyltriazolylpyridines as pesticides BAYER ANIMAL HEALTH GMBH (DE) 2019-05-28 US claimed
EP-3157913-B1 PYRAZOLYL TRIAZOLYL PYRIDINES AS PESTICIDE BAYER ANIMAL HEALTH GMBH (DE) 2019-04-17 EP claimed
US-10208015-B2 Aryl-triazolyl pyridines as pest control agents BAYER ANIMAL HEALTH GMBH (DE) 2019-02-19 US claimed
WO-2019025153-A1 USE OF SUBSTITUTED N-SULFONYL-N'-ARYL DIAMINOALKANES AND N-SULFONYL-N'-HETEROARYL DIAMINOALKANES OR SALTS THEREOF FOR INCREASING THE STRESS TOLERANCE IN PLANTS BAYER CROPSCIENCE AKTIENGESELLSCHAFT (DE) 2019-02-07 WO claimed
US-10065926-B2 Use of substituted dihydrooxindolylsulfonamides, or the salts thereof, for increasing the stress tolerance of plants BAYER CROPSCIENCE AKTIENGESELLSCHAFT (DE) 2018-09-04 US claimed
US-20180084782-A1 METHOD OF CONTROL OF STINKBUGS SYNGENTA PARTICIPATIONS AG (CH) 2018-03-29 US claimed
EP-3051946-B1 USE OF SUBSTITUTED DIHYDROOXINDOLYLSULFONAMIDES OR THEIR SALTS FOR INCREASING STRESS TOLERANCE IN PLANTS BAYER CROPSCIENCE AG (DE) 2017-11-29 EP claimed
WO-2004022542-A2 SUBSTITUTED 1,2,3,4-TETRAHYDROQUINOLINE DERIVATIVES Grünenthal GmbH (DE) 2004-03-18 WO claimed
US-6699855-B2 PYRROLOPYRAZINONES USEFUL AS SERINE PROTEASE INHIBITORS BRISTOL-MYERS SQUIBB COMPANY 2004-03-02 US claimed
EP-1181279-A4 DIKETODIAZACYCLIC COMPOUNDS, DIAZACYCLIC COMPOUNDS AND COMBINATORIAL LIBRARIES THEREOF TORREY PINES INST (US) 2002-09-25 EP claimed
US-20020123468-A1 Alpha-ketoamide inhibitors of hepatitis C virus NS3 protease BRISTOL-MYERS SQUIBB PHARMA COMPANY 2002-09-05 US claimed
US-20020065248-A1 Inhibitors of hepatitis C virus NS3 protease BRISTOL-MYERS SQUIBB PHARMA COMPANY 2002-05-30 US claimed
EP-1181279-A1 DIKETODIAZACYCLIC COMPOUNDS, DIAZACYCLIC COMPOUNDS AND COMBINATORIAL LIBRARIES THEREOF TORREY PINES INSTITUTE FOR MOLECULAR STUDIES (US) 2002-02-27 EP claimed
WO-2000069830-A1 DIKETODIAZACYCLIC COMPOUNDS, DIAZACYCLIC COMPOUNDS AND COMBINATORIAL LIBRARIES THEREOF TORREY PINES INSTITUTE FOR MOLECULAR STUDIES (US) 2000-11-23 WO claimed
EP-0550113-B1 Triazolopyrimidine derivatives with fungicidal activity SHELL INT RESEARCH (NL) 1997-10-15 EP claimed
US-5593996-A FUNGICIDES AMERICAN CYANAMID COMPANY (US) 1997-01-14 US claimed
EP-0550113-A2 Triazolopyrimidine derivatives with fungicidal activity SHELL INTERNATIONALE RESEARCHMAATSCHAPPIJ B.V. (NL) 1993-07-07 EP claimed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (6 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-10065926-B2 Use of substituted dihydrooxindolylsulfonamides, or the salts thereof, for increasing the stress tolerance of plants SQOR, DHPS, QDPR IDO1 610/4885ALDH1A1 652/4885KDM4E 3040/4885
US-10299478-B2 Pyrazolyltriazolylpyridines as pesticides PRDX4, PRDX1, ATL3 IDO1 112/4885ALDH1A1 1058/4885KDM4E 1853/4885
US-20020065248-A1 Inhibitors of hepatitis C virus NS3 protease TMPRSS15, CTRC, CPN1 IDO1 1672/4885ALDH1A1 1353/4885KDM4E 2706/4885
US-20180084782-A1 METHOD OF CONTROL OF STINKBUGS BROX, TUBB4B, TUBB4A IDO1 3043/4885ALDH1A1 929/4885KDM4E 1776/4885
US-10208015-B2 Aryl-triazolyl pyridines as pest control agents PTMS, TYR, PDXK IDO1 8/4885ALDH1A1 2031/4885KDM4E 394/4885
US-20020123468-A1 Alpha-ketoamide inhibitors of hepatitis C virus NS3 protease CES1, CYP51A1, SPINT2 IDO1 525/4885ALDH1A1 697/4885KDM4E 643/4885

“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.