SCHEMBL16730286

SCHEMBL16730286

Cc1cc(N)ccc1N1CCC=C(N2CCOCC2)C1=O

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 5/20 0.46
▸ GAA P10253 3/20 0.46
▸ SMN1; SMN2 Q16637 2/20 0.46
▸ ALDH1A1 P00352 3/20 0.43
▸ MEN1 O00255 2/20 0.43
▸ THRB P10828 2/20 0.43
▸ KMT2A Q03164 2/20 0.43
▸ NR4A1 P22736 1/20 0.43
▸ PTK2B Q14289 1/20 0.43
▸ RAF1 P04049 2/20 0.42
▸ L3MBTL1 Q9Y468 2/20 0.41
▸ LMNA P02545 2/20 0.40
▸ NSD2 O96028 1/20 0.40
▸ RAD52 P43351 1/20 0.39
▸ GFER P55789 1/20 0.39
▸ BRAF P15056 2/20 0.37
▸ ALOX15 P16050 2/20 0.37
▸ KDM4E B2RXH2 1/20 0.37
▸ TP53 P04637 1/20 0.37
▸ STAT3 P40763 1/20 0.37

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
SCHEMBL16730431 0.85 MAPT (0.44) MAPTGAASMN1; SMN2ALDH1A1NR4A1
SCHEMBL16730284 0.82 ALDH1A1 (0.48) MAPTSMN1; SMN2ALDH1A1MEN1KMT2A
SCHEMBL16730288 0.81 ALDH1A1 (0.53) MAPTSMN1; SMN2ALDH1A1MEN1KMT2A
SCHEMBL16730424 0.80 ALDH1A1 (0.49) MAPTSMN1; SMN2ALDH1A1MEN1KMT2A
SCHEMBL15731795 0.79 PIK3R1 (0.39) MAPTGAASMN1; SMN2ALDH1A1MEN1
SCHEMBL16730291 0.78 ALDH1A1 (0.50) MAPTSMN1; SMN2ALDH1A1MEN1KMT2A
SCHEMBL519230 0.78 MAPT (0.69) MAPTGAASMN1; SMN2ALDH1A1MEN1
SCHEMBL16730289 0.78 LGMN (0.43) MAPTGAASMN1; SMN2ALDH1A1MEN1
SCHEMBL17576245 0.75 AKR1C3 (0.44) MAPTGAASMN1; SMN2ALDH1A1MEN1
SCHEMBL18028138 0.75 MAPT (0.45) MAPTSMN1; SMN2ALDH1A1MEN1THRB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9815833-B2 Pyridine derivative and medical use thereof CHENGDU EASTON BIOPHARMACEUTICALS CO., LTD. (CN) 2017-11-14 — — US disclosed
US-9815833-B2 Pyridine derivative and medical use thereof CHENGDU EASTON BIOPHARMACEUTICALS CO., LTD. (CN) 2017-11-14 — — US disclosed
EP-3072892-A1 PYRIDINE DERIVATIVE AND MEDICAL USE THEREOF Chengdu Easton Biopharmaceuticals Co., Ltd. (CN) 2016-09-28 — — EP disclosed
US-20160244440-A1 PYRIDINE DERIVATIVE AND MEDICAL USE THEREOF Zhejiang Yatai Pharmaceutical Co., Ltd. (CN) 2016-08-25 — — US disclosed
US-20160244440-A1 PYRIDINE DERIVATIVE AND MEDICAL USE THEREOF Zhejiang Yatai Pharmaceutical Co., Ltd. (CN) 2016-08-25 — — US disclosed
WO-2015070809-A1 PYRIDINE DERIVATIVE AND MEDICAL USE THEREOF 成都苑东药业有限公司 2015-05-21 — — 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-20160244440-A1 PYRIDINE DERIVATIVE AND MEDICAL USE THEREOF PEPD, F2, XDH MAPT 4645/4885GAA 1794/4885SMN1; SMN2 4528/4885

“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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