SCHEMBL2606098

SCHEMBL2606098

N=Cc1ccc(-c2ccccc2)cc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.50
CA1 P00915 2/20 0.46
MGLL Q99685 2/20 0.46
TP53 P04637 1/20 0.46
MAPT P10636 2/20 0.45
LMNA P02545 1/20 0.45
KIF11 P52732 1/20 0.44
CYP3A4 P08684 3/20 0.43
CYP1A2 P05177 2/20 0.43
MAPK1 P28482 2/20 0.43
TAAR1 Q96RJ0 2/20 0.43
HSD17B10 Q99714 1/20 0.43
TDP1 Q9NUW8 1/20 0.43
MMP3 P08254 1/20 0.43
BCL2L1 Q07817 1/20 0.43
CYP2C9 P11712 1/20 0.42
ATM Q13315 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
HDAC2 Q92769 2/20 0.42
NPC1 O15118 1/20 0.41

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
SCHEMBL25978983 0.91 ASIC1 (0.46) ALDH1A1CA1MGLLTP53MAPT
SCHEMBL25978985 0.91 ASIC1 (0.46) ALDH1A1CA1MGLLTP53MAPT
SCHEMBL25978986 0.91 ASIC1 (0.46) ALDH1A1CA1MGLLTP53MAPT
SCHEMBL25978980 0.91 ASIC1 (0.46) ALDH1A1CA1MGLLTP53MAPT
SCHEMBL25978979 0.91 ASIC1 (0.46) ALDH1A1CA1MGLLTP53MAPT
SCHEMBL25978992 0.91 ASIC1 (0.46) ALDH1A1CA1MGLLTP53MAPT
SCHEMBL25978989 0.91 ASIC1 (0.46) ALDH1A1CA1MGLLTP53MAPT
SCHEMBL19844176 0.88 KIF11 (0.35) ALDH1A1CA1MGLLTP53MAPT
SCHEMBL14901641 0.87 MMP3 (0.39) ALDH1A1CA1MGLLTP53MAPT
SCHEMBL28248373 0.82 LMNA (0.48) ALDH1A1MAPTLMNACYP1A2MAPK1

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
US-11737348-B2 Halide material and optical unit and optoelectronic device having the same NATIONAL TSING HUA UNIVERSITY (TW) 2023-08-22 US disclosed
US-11737348-B2 Halide material and optical unit and optoelectronic device having the same NATIONAL TSING HUA UNIVERSITY (TW) 2023-08-22 US disclosed
WO-2023102507-A1 MACROCYCLIC IMMUNOMODULATORS BRISTOL-MYERS SQUIBB COMPANY (US) 2023-06-08 WO disclosed
EP-3764416-A1 COMPOUND FOR ORGANIC ELECTRONIC ELEMENT, ORGANIC ELECTRONIC ELEMENT USING THE SAME, AND AN ELECTRONIC DEVICE THEREOF Duk San Neolux Co., Ltd. (KR) 2021-01-13 EP disclosed
WO-2018116203-A1 NEW PROCESS FOR EARLY SACUBITRIL INTERMEDIATES NOVARTIS AG (CH) 2018-06-28 WO disclosed
WO-2017171421-A1 NOVEL PYRIMIDINE-4-CARBOXYLIC ACID DERIVATIVE HAVING ANTICANCER ACTIVITY 한국과학기술연구원 2017-10-05 WO disclosed
WO-2017105041-A1 ORGANIC COMPOUND AND ORGANIC ELECTROLUMINESCENT DEVICE COMPRISING SAME 주식회사 두산 2017-06-22 WO disclosed
EP-2260023-B1 FLUORENE DERIVATIVES FOR ORGANIC ELECTROLUMINESCENCE DEVICES MERCK PATENT GMBH (DE) 2012-04-25 EP disclosed
EP-1667959-A1 BIPHENYLOXY-ACIDS Wyeth (US) 2006-06-14 EP disclosed
WO-2005030702-A1 BIPHENYLOXY-ACIDS WYETH (US) 2005-04-07 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 (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-11737348-B2 Halide material and optical unit and optoelectronic device having the same MLX, BRIX1, TBL1XR1 ALDH1A1 488/4885CA1 3796/4885MGLL 1193/4885

“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.