SCHEMBL12469464

SCHEMBL12469464

Cc1cc(C(=O)NCCCn2ccnc2)nc(Cl)n1

nearest known ligand 0.56

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 3/20 0.56
MEN1 O00255 3/20 0.56
KMT2A Q03164 3/20 0.56
ALDH1A1 P00352 1/20 0.56
CYP19A1 P11511 1/20 0.56
LMNA P02545 1/20 0.56
NPC1 O15118 1/20 0.55
NAMPT P43490 1/20 0.55
PKM P14618 1/20 0.53

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
SCHEMBL9906905 0.79 MEN1 (0.65) SMN1; SMN2MEN1KMT2AALDH1A1CYP19A1
SCHEMBL12469106 0.79 MEN1 (0.65) SMN1; SMN2MEN1KMT2AALDH1A1LMNA
SCHEMBL12330491 0.76 MEN1 (0.70) SMN1; SMN2MEN1KMT2AALDH1A1CYP19A1
SCHEMBL12704522 0.75 MAPT (0.62) SMN1; SMN2MEN1KMT2AALDH1A1LMNA
SCHEMBL10920342 0.75 SMN1; SMN2 (0.64) SMN1; SMN2MEN1KMT2AALDH1A1CYP19A1
SCHEMBL5364762 0.75 POLB (0.49) SMN1; SMN2MEN1KMT2AALDH1A1LMNA
SCHEMBL21098369 0.73 SMN1; SMN2 (0.89) SMN1; SMN2MEN1KMT2AALDH1A1CYP19A1
SCHEMBL13211944 0.73 SMN1; SMN2 (0.78) SMN1; SMN2MEN1KMT2AALDH1A1CYP19A1
SCHEMBL6571604 0.73 SMN1; SMN2 (0.84) SMN1; SMN2MEN1KMT2AALDH1A1CYP19A1
SCHEMBL5216107 0.73 SMN1; SMN2 (0.73) SMN1; SMN2MEN1KMT2AALDH1A1CYP19A1

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-20220348577-A1 CXCR4 Receptor Antagonists PROXIMAGEN LLC (US) 2022-11-03 US disclosed
US-10995091-B2 CXCR4 receptor antagonists PROXIMAGEN LLC (US) 2021-05-04 US disclosed
US-10995091-B2 CXCR4 receptor antagonists PROXIMAGEN LLC (US) 2021-05-04 US disclosed
US-10155761-B2 CXCR4 receptor antagonists PROXIMAGEN, LLC (US) 2018-12-18 US disclosed
EP-2927224-B1 Receptor antagonists PROXIMAGEN LTD (GB) 2018-10-03 EP disclosed
US-20170226106-A1 CXCR4 Receptor Antagonists PROXIMAGEN, LLC 2017-08-10 US disclosed
US-20170226106-A1 CXCR4 Receptor Antagonists PROXIMAGEN, LLC 2017-08-10 US disclosed
US-20170226106-A1 CXCR4 Receptor Antagonists PROXIMAGEN, LLC 2017-08-10 US disclosed
US-9353086-B2 CXCR4 receptor antagonists PROXIMAGEN LIMITED (GB) 2016-05-31 US disclosed
US-9353086-B2 CXCR4 receptor antagonists PROXIMAGEN LIMITED (GB) 2016-05-31 US disclosed
US-20160046606-A1 CXCR4 Receptor Antagonists PROXIMAGEN LIMITED (GB) 2016-02-18 US disclosed
US-20160046606-A1 CXCR4 Receptor Antagonists PROXIMAGEN LIMITED (GB) 2016-02-18 US disclosed
US-20160046606-A1 CXCR4 Receptor Antagonists PROXIMAGEN LIMITED (GB) 2016-02-18 US disclosed
EP-2927224-A1 Receptor antagonists Proximagen Limited (GB) 2015-10-07 EP disclosed
EP-2627649-B1 CXCR4 RECEPTOR ANTAGONISTS PROXIMAGEN LTD (GB) 2015-04-08 EP disclosed
EP-2627649-B1 CXCR4 RECEPTOR ANTAGONISTS PROXIMAGEN LTD (GB) 2015-04-08 EP disclosed
US-20130289020-A1 CXCR4 Receptor Antagonists PROXIMAGEN LIMITED (GB) 2013-10-31 US disclosed
EP-2627649-A1 CXCR4 RECEPTOR ANTAGONISTS Proximagen Limited (GB) 2013-08-21 EP disclosed
WO-2012049277-A1 CXCR4 RECEPTOR ANTAGONISTS PROXIMAGEN LTD (GB) 2012-04-19 WO disclosed
WO-2012049277-A1 CXCR4 RECEPTOR ANTAGONISTS PROXIMAGEN LTD (GB) 2012-04-19 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 (6 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-20170226106-A1 CXCR4 Receptor Antagonists CXCR4, CXCR1, CXCR2 SMN1; SMN2 4054/4885MEN1 3457/4885KMT2A 3673/4885
US-20220348577-A1 CXCR4 Receptor Antagonists CXCR4, CXCR1, CXCR2 SMN1; SMN2 4054/4885MEN1 3457/4885KMT2A 3673/4885
US-20130289020-A1 CXCR4 Receptor Antagonists CXCR4, ACKR3, CXCR1 SMN1; SMN2 4635/4885MEN1 4678/4885KMT2A 4328/4885
US-10155761-B2 CXCR4 receptor antagonists CXCR4, CXCR1, CXCR2 SMN1; SMN2 4054/4885MEN1 3457/4885KMT2A 3673/4885
US-20160046606-A1 CXCR4 Receptor Antagonists CXCR4, CXCR1, CXCR2 SMN1; SMN2 4054/4885MEN1 3457/4885KMT2A 3673/4885
US-10995091-B2 CXCR4 receptor antagonists CXCR4, CXCR1, CXCR2 SMN1; SMN2 4054/4885MEN1 3457/4885KMT2A 3673/4885

“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.