SCHEMBL4846671

SCHEMBL4846671

O=Cc1ccccc1-c1ccccc1C(F)(F)F

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.46
LMNA P02545 1/20 0.46
THRB P10828 1/20 0.46
BLM P54132 1/20 0.46
KMT2A Q03164 1/20 0.46
TDP1 Q9NUW8 1/20 0.46
NFKB1 P19838 1/20 0.46
PSMB8 P28062 1/20 0.44
HSD11B1 P28845 1/20 0.42
ALDH1A1 P00352 2/20 0.41
HPGD P15428 1/20 0.41
TNF P01375 1/20 0.41
IL6 P05231 1/20 0.41
NOTUM Q6P988 2/20 0.40
MAOB P27338 1/20 0.39
TSHR P16473 1/20 0.39
TRIM24 O15164 1/20 0.39
TRIM33 Q9UPN9 1/20 0.39
PIM1 P11309 1/20 0.39
PIM3 Q86V86 1/20 0.39

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
SCHEMBL28336820 0.85 NFKB1 (0.45) MEN1LMNATHRBBLMKMT2A
SCHEMBL1125930 0.84 NFKB1 (0.40) MEN1LMNATHRBBLMKMT2A
SCHEMBL29417728 0.83 NFKB1 (0.57) MEN1LMNATHRBBLMKMT2A
SCHEMBL67207 0.83 NFKB1 (0.57) MEN1LMNATHRBBLMKMT2A
SCHEMBL28066003 0.83 KIF11 (0.41) NFKB1PSMB8HSD11B1ALDH1A1HPGD
SCHEMBL26262578 0.81 ERN1 (0.42) NFKB1PSMB8HSD11B1ALDH1A1HPGD
SCHEMBL27016125 0.81 HSD11B1 (0.41) LMNATDP1HSD11B1ALDH1A1TSHR
SCHEMBL7083651 0.80 HSD11B1 (0.42) NFKB1HSD11B1ALDH1A1HPGDTNF
SCHEMBL31175932 0.80 KMT2A (0.71) MEN1LMNATHRBBLMKMT2A
SCHEMBL249552 0.80 KMT2A (0.71) MEN1LMNATHRBBLMKMT2A

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 7 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7345079-B2 Treatment of disorder related to low cyclic GMP levels YUNG SHIN PHARMACEUTICALS INDUSTRIAL CO., LTD (TW) 2008-03-18 US disclosed
EP-1425015-A4 TETRAHYDROQUINOLINE DERIVATIVES AS ANTITHROMBOTIC AGENTS BRISTOL MYERS SQUIBB CO (US) 2004-12-15 EP disclosed
EP-1425015-A2 TETRAHYDROQUINOLINE DERIVATIVES AS ANTITHROMBOTIC AGENTS BRISTOL-MYERS SQUIBB COMPANY (US) 2004-06-09 EP disclosed
US-20030220385-A1 Treatment of disorder related to low cyclic GMP levels YUNG SHIN PHARMACEUTICALS INDUSTRIAL CO., LT.D (TW) 2003-11-27 US disclosed
WO-2003015715-A2 TETRAHYDROQUINOLINE DERIVATIVES AS ANTITHROMBOTIC AGENTS BRISTOL-MYERS SQUIBB COMPANY (US) 2003-02-27 WO disclosed
US-4753936-A CARDIOVASCULAR DISORDERS BAYER AKTIENGESELLSCHAFT (DE) 1988-06-28 US disclosed
EP-0234196-A1 Substituted 1,4-dihydropyridine-3-carboxylic acid piperazides, process for their preparation and their use in medicaments BAYER AG (DE) 1987-09-02 EP 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-20030220385-A1 Treatment of disorder related to low cyclic GMP levels PDE7A, PDE2A, PDE4A MEN1 2548/4885LMNA 1031/4885THRB 830/4885

“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.