SCHEMBL4862640

SCHEMBL4862640

CC(C)(Cc1ccc(Br)cc1)NC(=O)CCl

nearest known ligand 0.47

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.47
MEN1 O00255 4/20 0.46
KMT2A Q03164 4/20 0.46
TSHR P16473 1/20 0.46
MAPT P10636 2/20 0.45
POLB P06746 1/20 0.42
L3MBTL1 Q9Y468 2/20 0.42
ALDH1A1 P00352 2/20 0.42
CYP3A4 P08684 1/20 0.42
CYP2C9 P11712 1/20 0.42
CYP2C19 P33261 1/20 0.42
KDM4E B2RXH2 2/20 0.41
GLA P06280 1/20 0.41
HPGD P15428 1/20 0.41
NPC1 O15118 1/20 0.39
RAB9A P51151 1/20 0.39
HTT P42858 1/20 0.39
SMN1; SMN2 Q16637 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
SCHEMBL15261415 0.85 HPGD (0.57) LMNAMEN1KMT2ATSHRPOLB
SCHEMBL12802344 0.85 L3MBTL1 (0.58) LMNAMEN1KMT2ATSHRMAPT
SCHEMBL4938661 0.84 KDM4E (0.56) LMNAMEN1KMT2ATSHRMAPT
SCHEMBL5913849 0.83 CYP3A4 (0.59) LMNAMEN1KMT2ATSHRMAPT
SCHEMBL5034363 0.83 L3MBTL1 (0.48) LMNAMEN1KMT2ATSHRMAPT
SCHEMBL2454332 0.82 TAAR1 (0.43) L3MBTL1ALDH1A1CYP3A4CYP2C9CYP2C19
SCHEMBL16041240 0.81 ALDH1A1 (0.49) LMNAMEN1KMT2ATSHRMAPT
SCHEMBL6621894 0.81 ACACB (0.52) LMNAMEN1KMT2ATSHRMAPT
SCHEMBL25342779 0.81 LMNA (0.46) LMNAMEN1KMT2ATSHRL3MBTL1
SCHEMBL2777352 0.81 HTT (0.44) MEN1KMT2ATSHRMAPTL3MBTL1

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
CN-102834394-B Bicyclic quinolone compounds, preparation and application thereof KBP BIOSCIENCES CO LTD 2015-03-25 CN disclosed
WO-2011124093-A1 BICYCLIC QUINOLONE COMPOUNDS, PREPARATION METHODS AND USES THEREOF 山东轩竹医药科技有限公司 (CN) 2011-10-13 WO disclosed
US-7375100-B2 2-amino-pyridine derivatives useful for the treatment of diseases PFIZER INC (US) 2008-05-20 US disclosed
US-7375100-B2 2-amino-pyridine derivatives useful for the treatment of diseases PFIZER INC (US) 2008-05-20 US disclosed
US-7375100-B2 2-amino-pyridine derivatives useful for the treatment of diseases PFIZER INC (US) 2008-05-20 US disclosed
EP-1633715-B1 2-(6-AMINO-PYRIDIN-3-YL)-2-HYDROXYETHYLAMINE DERIVATIVES AS BETA 2-ADRENOCEPTORS AGONISTS PFIZER LTD (GB) 2007-09-05 EP disclosed
US-20050014763-A1 2-Amino-pyridine derivatives useful for the treatment of diseases PFIZER INC 2005-01-20 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 (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-20050014763-A1 2-Amino-pyridine derivatives useful for the treatment of diseases PAH, AADAT, IL4I1 LMNA 2688/4885MEN1 2743/4885KMT2A 1417/4885

“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.