SCHEMBL16150656

SCHEMBL16150656

Cc1cc(Cl)nc(Cl)c1C(=O)OC(C)(C)C

nearest known ligand 0.46

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.46
MAPK1 P28482 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
KMT2A Q03164 3/20 0.43
MEN1 O00255 2/20 0.43
CYP2C9 P11712 1/20 0.43
CYP2C19 P33261 1/20 0.43
NPSR1 Q6W5P4 1/20 0.43
TAAR1 Q96RJ0 1/20 0.42
POLB P06746 1/20 0.41
LCK P06239 1/20 0.38
CNR1 P21554 1/20 0.37
CNR2 P34972 1/20 0.37
ATR Q13535 1/20 0.37
HSP90AA1 P07900 1/20 0.36
HSP90AB1 P08238 1/20 0.36
LMNA P02545 1/20 0.36
GRM6 O15303 1/20 0.35

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
SCHEMBL17541649 0.88 ALDH1A1 (0.47) ALDH1A1MAPK1SMN1; SMN2KMT2AMEN1
SCHEMBL30424032 0.84 HSP90AA1 (0.40) ALDH1A1MAPK1SMN1; SMN2KMT2AMEN1
SCHEMBL1235136 0.84 HSP90AA1 (0.40) ALDH1A1MAPK1SMN1; SMN2KMT2AMEN1
SCHEMBL16149260 0.84 CYP2C9 (0.44) ALDH1A1MAPK1SMN1; SMN2KMT2AMEN1
SCHEMBL25289588 0.81 CYP2C9 (0.39) ALDH1A1MAPK1SMN1; SMN2KMT2AMEN1
SCHEMBL3757830 0.81 CACNA1B (0.41) ALDH1A1MAPK1SMN1; SMN2KMT2ACYP2C9
SCHEMBL30496249 0.81 CYP2C9 (0.39) ALDH1A1MAPK1SMN1; SMN2KMT2AMEN1
SCHEMBL30430258 0.81 ALDH1A1 (0.50) ALDH1A1MAPK1SMN1; SMN2KMT2AMEN1
SCHEMBL1085042 0.81 ALDH1A1 (0.50) ALDH1A1MAPK1SMN1; SMN2KMT2AMEN1
SCHEMBL31664072 0.80 ATR (0.44) CYP2C9CYP2C19NPSR1LCKATR

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 21 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10138253-B2 Imidazopyridine macrocycles as inhibitors of human immunodeficiency virus replication VIIV Healthcare UK (No.5) Limited (GB) 2018-11-27 US disclosed
US-20180222901-A1 IMIDAZO[1,2-A]PYRIDINE DERIVATIVES FOR USE AS INHIBITORS OF HUMAN IMMUNODEFICIENCY VIRUS REPLICATION BRISTOL-MYERS SQUIBB COMPANY 2018-08-09 US disclosed
US-20180222901-A1 IMIDAZO[1,2-A]PYRIDINE DERIVATIVES FOR USE AS INHIBITORS OF HUMAN IMMUNODEFICIENCY VIRUS REPLICATION BRISTOL-MYERS SQUIBB COMPANY 2018-08-09 US disclosed
EP-3334741-A1 IMIDAZOPYRIDINE MACROCYCLES AS INHIBITORS OF HUMAN IMMUNODEFICIENCY VIRUS REPLICATION VIIV Healthcare UK (No.5) Limited (GB) 2018-06-20 EP disclosed
US-9655889-B2 Inhibitors of human immunodeficiency virus replication VIIV Healthcare UK (No.5) Limited (GB) 2017-05-23 US disclosed
US-9655889-B2 Inhibitors of human immunodeficiency virus replication VIIV Healthcare UK (No.5) Limited (GB) 2017-05-23 US disclosed
US-9655889-B2 Inhibitors of human immunodeficiency virus replication VIIV Healthcare UK (No.5) Limited (GB) 2017-05-23 US disclosed
EP-2970273-B1 INHIBITORS OF HUMAN IMMUNODEFICIENCY VIRUS REPLICATION VIIV HEALTHCARE UK (NO 5) LTD (GB) 2017-03-01 EP disclosed
EP-2970273-B1 INHIBITORS OF HUMAN IMMUNODEFICIENCY VIRUS REPLICATION VIIV HEALTHCARE UK (NO 5) LTD (GB) 2017-03-01 EP disclosed
WO-2017025913-A1 IMIDAZOPYRIDINE MACROCYCLES AS INHIBITORS OF HUMAN IMMUNODEFICIENCY VIRUS REPLICATION VIIV Healthcare UK (No.5) Limited (GB) 2017-02-16 WO disclosed
EP-3114129-A1 IMIDAZOPYRIDINE MACROCYCLES AS INHIBITORS OF HUMAN IMMUNODEFICIENCY VIRUS REPLICATION VIIV Healthcare UK (No.5) Limited (GB) 2017-01-11 EP disclosed
US-9409922-B2 Imidazopyridine macrocycles as inhibitors of human immunodeficiency virus replication BRISTOL-MYERS SQUIBB COMPANY (US) 2016-08-09 US disclosed
US-9409922-B2 Imidazopyridine macrocycles as inhibitors of human immunodeficiency virus replication BRISTOL-MYERS SQUIBB COMPANY (US) 2016-08-09 US disclosed
EP-2970273-A1 INHIBITORS OF HUMAN IMMUNODEFICIENCY VIRUS REPLICATION Bristol-Myers Squibb Company (US) 2016-01-20 EP disclosed
US-20160000771-A1 Inhibitors of Human Immunodeficiency Virus Replication VIIV HEALTHCARE UK (NO. 5) LIMITED (GB) 2016-01-07 US disclosed
US-20160000771-A1 Inhibitors of Human Immunodeficiency Virus Replication VIIV HEALTHCARE UK (NO. 5) LIMITED (GB) 2016-01-07 US disclosed
WO-2015126751-A1 IMIDAZOPYRIDINE MACROCYCLES AS INHIBITORS OF HUMAN IMMUNODEFICIENCY VIRUS REPLICATION BRISTOL-MYERS SQUIBB COMPANY (US) 2015-08-27 WO disclosed
US-20150232480-A1 Imidazopyridine Macrocycles as Inhibitors of Human Immunodeficiency Virus Replication VIIV HEALTHCARE UK (NO. 5) LIMITED (GB) 2015-08-20 US disclosed
US-20150232480-A1 Imidazopyridine Macrocycles as Inhibitors of Human Immunodeficiency Virus Replication VIIV HEALTHCARE UK (NO. 5) LIMITED (GB) 2015-08-20 US disclosed
WO-2014164409-A1 INHIBITORS OF HUMAN IMMUNODEFICIENCY VIRUS REPLICATION BRISTOL-MYERS SQUIBB COMPANY (US) 2014-10-09 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 (4 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-20180222901-A1 IMIDAZO[1,2-A]PYRIDINE DERIVATIVES FOR USE AS INHIBITORS OF HUMAN IMMUNODEFICIENCY VIRUS REPLICATION MAVS, EIF2AK2, ITPA ALDH1A1 2086/4885MAPK1 451/4885SMN1; SMN2 3459/4885
US-20160000771-A1 Inhibitors of Human Immunodeficiency Virus Replication EIF2AK2, RTF2, MAVS ALDH1A1 3508/4885MAPK1 1620/4885SMN1; SMN2 3068/4885
US-20150232480-A1 Imidazopyridine Macrocycles as Inhibitors of Human Immunodeficiency Virus Replication EIF2AK2, MAVS, TYMP ALDH1A1 3105/4885MAPK1 967/4885SMN1; SMN2 2620/4885
US-10138253-B2 Imidazopyridine macrocycles as inhibitors of human immunodeficiency virus replication TYMP, TYMS, CCNI ALDH1A1 1756/4885MAPK1 2140/4885SMN1; SMN2 2275/4885

“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.