SCHEMBL6095770

SCHEMBL6095770

CC1c2ccccc2C(=O)N1C(=O)O

nearest known ligand 0.45

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 4/20 0.43
▸ KMT2A Q03164 4/20 0.43
▸ ALDH1A1 P00352 3/20 0.41
▸ POLB P06746 3/20 0.41
▸ HPGD P15428 1/20 0.41
▸ GPR3 P46089 1/20 0.41
▸ ATM Q13315 1/20 0.41
▸ EDNRB P24530 1/20 0.40
▸ EDNRA P25101 1/20 0.40
▸ CYP1A2 P05177 3/20 0.39
▸ HTT P42858 2/20 0.39
▸ CYP3A4 P08684 2/20 0.39
▸ CYP2C9 P11712 2/20 0.39
▸ FFAR1 O14842 1/20 0.39
▸ LMNA P02545 1/20 0.39
▸ GAA P10253 2/20 0.38
▸ KDM4E B2RXH2 2/20 0.38

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
SCHEMBL30825174 1.00 MEN1 (0.43) MEN1KMT2AALDH1A1POLBHPGD
SCHEMBL20738520 0.86 NOTUM (0.44) MEN1KMT2AALDH1A1POLBHPGD
SCHEMBL31373870 0.86 NOTUM (0.44) MEN1KMT2AALDH1A1POLBHPGD
SCHEMBL28029965 0.85 MEN1 (0.45) MEN1KMT2AALDH1A1POLBCYP1A2
SCHEMBL24926039 0.81 CES1 (0.46) MEN1KMT2AALDH1A1HPGDGPR3
SCHEMBL28247397 0.80 RAB9A (0.38) MEN1KMT2AALDH1A1POLBHPGD
SCHEMBL29338286 0.80 MEN1 (0.37) MEN1KMT2AALDH1A1HPGDGPR3
SCHEMBL28246631 0.80 EDNRB (0.44) MEN1KMT2AALDH1A1POLBHPGD
SCHEMBL28559637 0.79 ALDH1A1 (0.41) MEN1KMT2AALDH1A1POLBHPGD
SCHEMBL28159474 0.79 EDNRB (0.43) MEN1KMT2AALDH1A1POLBHPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3080120-B1 FUSED IMIDAZOLE AND PYRAZOLE DERIVATIVES AS MODULATORS OF TNF ACTIVITY UCB BIOPHARMA SPRL (BE) 2019-06-19 — — EP disclosed
CN-108601766-A Cxcr2 inhibitor 凯莫森特里克斯股份有限公司 2018-09-28 — — CN disclosed
US-10004737-B2 Fused imidazole and pyrazole derivatives as modulators of TNF activity UCB BIOPHARMA SPRL (BY) 2018-06-26 — — US disclosed
US-20170128445-A1 Fused Imidazole and Pyrazole Derivatives as Modulators of TNF Activity UCB BIOPHARMA SPRL (BE) 2017-05-11 — — US disclosed
EP-3080120-A1 FUSED IMIDAZOLE AND PYRAZOLE DERIVATIVES AS MODULATORS OF TNF ACTIVITY UCB Biopharma SPRL (BE) 2016-10-19 — — EP disclosed
WO-2015086512-A1 FUSED IMIDAZOLE AND PYRAZOLE DERIVATIVES AS MODULATORS OF TNF ACTIVITY UCB BIOPHARMA SPRL (BE) 2015-06-18 — — WO disclosed
US-7053122-B2 Therapeutic use of aryl amino acid derivatives PFIZER INC (US) 2006-05-30 — — US disclosed
EP-1528919-A2 THERAPEUTIC USE OF ARYL AMINO ACID DERIVATIVES Pfizer Limited (GB) 2005-05-11 — — EP disclosed
US-20040138197-A1 Therapeutic use of aryl amino acid derivatives MAW GRAHAM NIGEL (GB) 2004-07-15 — — US disclosed
WO-2004014357-A2 THERAPEUTIC USE OF ARYL AMINO ACID DERIVATIVES PFIZER LIMITED (GB) 2004-02-19 — — WO 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 (3 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-10004737-B2 Fused imidazole and pyrazole derivatives as modulators of TNF activity TNF, TNFRSF1A, TNFRSF9 MEN1 3445/4885KMT2A 4392/4885ALDH1A1 1594/4885
US-20170128445-A1 Fused Imidazole and Pyrazole Derivatives as Modulators of TNF Activity TNF, TNFRSF1A, TNFRSF9 MEN1 3409/4885KMT2A 4392/4885ALDH1A1 1651/4885
US-20040138197-A1 Therapeutic use of aryl amino acid derivatives CNR1, HCRTR1, HTR6 MEN1 3212/4885KMT2A 1495/4885ALDH1A1 776/4885

“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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