SCHEMBL8919414

SCHEMBL8919414

CNc1cc(NC(C)=O)ccc1Cl

nearest known ligand 0.60

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ HTT P42858 2/20 0.54
▸ PYGL P06737 1/20 0.53
▸ RORC P51449 3/20 0.50
▸ ALDH1A1 P00352 2/20 0.50
▸ KMT2A Q03164 1/20 0.50
▸ SMN1; SMN2 Q16637 3/20 0.49
▸ ATAD2 Q6PL18 1/20 0.49
▸ CECR2 Q9BXF3 1/20 0.49
▸ POLB P06746 2/20 0.48
▸ ESRRA P11474 1/20 0.48
▸ EPHX1 P07099 1/20 0.47
▸ EPHX2 P34913 1/20 0.47
▸ L3MBTL1 Q9Y468 1/20 0.47
▸ LMNA P02545 1/20 0.47

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
SCHEMBL3791892 0.89 ALDH1A1 (0.60) PYGLRORCALDH1A1KMT2ASMN1; SMN2
SCHEMBL14341158 0.81 PYGL (0.50) PYGLRORCALDH1A1KMT2ASMN1; SMN2
SCHEMBL9472463 0.81 PYGL (0.50) PYGLRORCALDH1A1KMT2ASMN1; SMN2
SCHEMBL4548035 0.81 EPHX1 (0.70) HTTRORCKMT2ASMN1; SMN2POLB
SCHEMBL7936658 0.79 KMT2A (0.54) PYGLRORCALDH1A1KMT2APOLB
SCHEMBL9231822 0.79 HTT (0.54) HTTPYGLALDH1A1KMT2ASMN1; SMN2
SCHEMBL3786506 0.78 ALDH1A1 (0.37) PYGLALDH1A1KMT2AEPHX1EPHX2
SCHEMBL405569 0.78 SMN1; SMN2 (0.59) HTTRORCALDH1A1KMT2ASMN1; SMN2
SCHEMBL3786387 0.78 CA1 (0.58) RORCALDH1A1KMT2ASMN1; SMN2ESRRA
SCHEMBL13602308 0.78 SMN1; SMN2 (0.59) HTTPYGLRORCALDH1A1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120238750-A1 AROMATIC COMPOUND OTSUKA PHARMACEUTICAL CO., LTD. 2012-09-20 — — US disclosed
US-20120238750-A1 AROMATIC COMPOUND OTSUKA PHARMACEUTICAL CO., LTD. 2012-09-20 — — US disclosed
US-8236826-B2 Diarylether derivatives as antitumor agents OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2012-08-07 — — US disclosed
US-8236826-B2 Diarylether derivatives as antitumor agents OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2012-08-07 — — US disclosed
US-8188277-B2 Aromatic compounds for suppressing the generation of collagen OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2012-05-29 — — US disclosed
US-8188277-B2 Aromatic compounds for suppressing the generation of collagen OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2012-05-29 — — US disclosed
US-20100004438-A1 DIARYLETHER DERIVATIVES AS ANTITUMOR AGENTS OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2010-01-07 — — US disclosed
US-20100004438-A1 DIARYLETHER DERIVATIVES AS ANTITUMOR AGENTS OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2010-01-07 — — US disclosed
US-20080165668-A1 RECORDING MEDIUM AND INFORMATION RECORDING AND REPRODUCING METHOD USING THE SAME FUJIFILM CORPORATION 2008-07-10 — — US disclosed
US-20080165668-A1 RECORDING MEDIUM AND INFORMATION RECORDING AND REPRODUCING METHOD USING THE SAME FUJIFILM CORPORATION 2008-07-10 — — US disclosed
US-20070270422-A1 Aromatic Compounds OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2007-11-22 — — US disclosed
US-20070270422-A1 Aromatic Compounds OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2007-11-22 — — US 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-20120238750-A1 AROMATIC COMPOUND CBR1, CBR3, CYP1A1 HTT 3655/4885PYGL 4326/4885RORC 1079/4885
US-20100004438-A1 DIARYLETHER DERIVATIVES AS ANTITUMOR AGENTS ROS1, CBR1, CBR3 HTT 4769/4885PYGL 2362/4885RORC 2565/4885
US-20070270422-A1 Aromatic Compounds COL1A1, COL2A1, COL14A1 HTT 3668/4885PYGL 2351/4885RORC 966/4885

“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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