SCHEMBL14909105

SCHEMBL14909105

Fc1cc(Cl)cc2cc[nH]c12

nearest known ligand 0.57

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ TNF P01375 1/20 0.57
▸ RIPK1 Q13546 1/20 0.57
▸ AHR P35869 5/20 0.45
▸ F7 P08709 1/20 0.45
▸ LTA4H P09960 1/20 0.45
▸ F3 P13726 1/20 0.45
▸ NR4A2 P43354 1/20 0.45
▸ GPR84 Q9NQS5 1/20 0.42
▸ CMA1 P23946 1/20 0.41
▸ IKBKB O14920 2/20 0.38
▸ CHUK O15111 2/20 0.38
▸ HRH4 Q9H3N8 4/20 0.38
▸ AR P10275 1/20 0.38
▸ CSNK2A1 P68400 1/20 0.37
▸ CYP2D6 P10635 2/20 0.35
▸ SLC6A2 P23975 2/20 0.35
▸ SLC6A4 P31645 2/20 0.35
▸ SLC6A3 Q01959 2/20 0.35
▸ KCNH2 Q12809 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
SCHEMBL2537652 0.80 AHR (0.50) TNFRIPK1AHRGPR84HRH4
SCHEMBL21315701 0.78 AHR (0.48) TNFRIPK1AHRF7LTA4H
SCHEMBL838245 0.78 AHR (0.54) TNFRIPK1AHRF7LTA4H
SCHEMBL794596 0.77 TNF (0.44) TNFRIPK1AHRGPR84IKBKB
SCHEMBL13961694 0.75 AHR (0.45) TNFRIPK1AHRF7LTA4H
SCHEMBL2599709 0.75 AHR (0.45) TNFRIPK1AHRF7LTA4H
SCHEMBL28600170 0.75 AHR (0.45) TNFRIPK1AHRF7LTA4H
SCHEMBL1397681 0.75 CSNK2A1 (0.46) TNFRIPK1AHRF7LTA4H
SCHEMBL1960195 0.75 USP2 (0.45) TNFRIPK1AHRGPR84CYP2D6
SCHEMBL1394068 0.75 TNF (0.42) TNFRIPK1AHRGPR84CYP2D6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2024201248-A1 COMPOUNDS AND METHODS FOR DEGRADING GSPT1 PIN THERAPEUTICS, INC. (KR) 2024-10-03 — — WO disclosed
CN-118359627-A MTA synergistic PRMT5 inhibitor compounds having a tetracyclic fused ring structure 烨辉医药科技(上海)有限公司 2024-07-19 — — CN disclosed
US-12018033-B2 Inhibitors of protein arginine deiminases FORWARD THERAPEUTICS, INC. (US) 2024-06-25 — — US disclosed
CN-107759571-B Inhibitors of influenza virus replication and methods of use and uses thereof 广东东阳光药业有限公司 2021-03-02 — — CN disclosed
US-20210024464-A1 BINDING FUNCTION 3 (BF3) SITE COMPOUNDS AS THERAPEUTICS AND METHODS FOR THEIR USE UNIV BRITISH COLUMBIA (CA) 2021-01-28 — — US disclosed
CN-106573920-B Indoles for use in influenza virus infection 爱尔兰詹森科学公司 2020-11-10 — — CN disclosed
US-10633338-B2 Binding Function 3 (BF3) site compounds as therapeutics and methods for their use THE UNIVERSITY OF BRITISH COLUMBIA (CA) 2020-04-28 — — US disclosed
US-10597390-B2 Indoles for use in influenza virus infection JANSSEN SCIENCES IRELAND UC (IE) 2020-03-24 — — US disclosed
US-10597390-B2 Indoles for use in influenza virus infection JANSSEN SCIENCES IRELAND UC (IE) 2020-03-24 — — US disclosed
US-20190300480-A1 BINDING FUNCTION 3 (BF3) SITE COMPOUNDS AS THERAPEUTICS AND METHODS FOR THEIR USE THE UNIVERSITY OF BRITISH COLUMBIA (CA) 2019-10-03 — — US disclosed
US-8809371-B2 — — 2014-08-19 — — US disclosed
US-8772320-B2 — — 2014-07-08 — — US disclosed
US-8772320-B2 — — 2014-07-08 — — US disclosed
WO-2013171712-A1 SUBSTITUTED 3, 4 - DIHYDRO - 2H - PYRIDO [1, 2 -A] PYRAZINE - 1, 6 - DIONE DERIVATIVES USEFUL FOR THE TREATMENT OF (INTER ALIA) ALZHEIMER'S DISEASE Janssen Pharmaceuticals, Inc. (US) 2013-11-21 — — WO disclosed
US-20130116430-A1 NOVEL NICOTINAMIDE DERIVATIVE OR SALT THEREOF FUJIFILM CORPORATION (JP) 2013-05-09 — — US disclosed
US-20130116430-A1 NOVEL NICOTINAMIDE DERIVATIVE OR SALT THEREOF FUJIFILM CORPORATION (JP) 2013-05-09 — — US disclosed
US-20130116430-A1 NOVEL NICOTINAMIDE DERIVATIVE OR SALT THEREOF FUJIFILM CORPORATION (JP) 2013-05-09 — — US disclosed
EP-2589592-A1 NOVEL NICOTINAMIDE DERIVATIVES OR SALTS THEREOF FUJIFILM Corporation (JP) 2013-05-08 — — EP disclosed
EP-2589592-A1 NOVEL NICOTINAMIDE DERIVATIVES OR SALTS THEREOF FUJIFILM Corporation (JP) 2013-05-08 — — EP disclosed
CN-102958918-A Novel nicotinamide derivatives or salts thereof FUJIFILM CORP 2013-03-06 — — CN 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 (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-20130116430-A1 NOVEL NICOTINAMIDE DERIVATIVE OR SALT THEREOF SYK, CD38, BTK TNF 2490/4885RIPK1 823/4885AHR 644/4885
US-20190300480-A1 BINDING FUNCTION 3 (BF3) SITE COMPOUNDS AS THERAPEUTICS AND METHODS FOR THEIR USE KLK3, SHBG, ACP3 TNF 4872/4885RIPK1 3261/4885AHR 4325/4885
US-10597390-B2 Indoles for use in influenza virus infection IDO1, IDO2, INMT TNF 2672/4885RIPK1 2094/4885AHR 14/4885
US-10633338-B2 Binding Function 3 (BF3) site compounds as therapeutics and methods for their use KLK3, SHBG, ACP3 TNF 4872/4885RIPK1 3261/4885AHR 4325/4885
US-20210024464-A1 BINDING FUNCTION 3 (BF3) SITE COMPOUNDS AS THERAPEUTICS AND METHODS FOR THEIR USE KLK3, SHBG, ACP3 TNF 4872/4885RIPK1 3261/4885AHR 4325/4885
US-12018033-B2 Inhibitors of protein arginine deiminases PADI2, PADI1, PADI4 TNF 4080/4885RIPK1 806/4885AHR 3636/4885

“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.

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