SCHEMBL12685192

SCHEMBL12685192

CC1CCNCCN1c1cccc(C(=O)NCC2CC2)n1

nearest known ligand 0.51

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
NAPEPLD Q6IQ20 14/20 0.51
PIM1 P11309 1/20 0.44
CHRM1 P11229 1/20 0.42
ACACB O00763 1/20 0.42
ACACA Q13085 1/20 0.42
HTR4 Q13639 1/20 0.41
CNR1 P21554 1/20 0.40

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
SCHEMBL15347556 0.81 NAPEPLD (0.52) NAPEPLDACACBACACA
SCHEMBL30076931 0.81 NAPEPLD (0.52) NAPEPLDACACBACACA
SCHEMBL17523565 0.78 NAPEPLD (0.48) NAPEPLDPIM1CHRM1ACACBACACA
SCHEMBL12685120 0.77 NAPEPLD (0.49) NAPEPLD
SCHEMBL30076917 0.77 NAPEPLD (0.49) NAPEPLD
SCHEMBL19222497 0.77 NAPEPLD (0.43) NAPEPLDPIM1CHRM1ACACBACACA
SCHEMBL15347593 0.77 HTR4 (0.44) NAPEPLDHTR4
SCHEMBL30077153 0.77 HTR4 (0.44) NAPEPLDHTR4
SCHEMBL12685237 0.76 NAPEPLD (0.48) NAPEPLDPIM1ACACBACACA
SCHEMBL30077109 0.76 NAPEPLD (0.48) NAPEPLDPIM1ACACBACACA

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 19 patents. 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-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
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 NAPEPLD 2860/4885PIM1 2753/4885CHRM1 336/4885
US-20220348577-A1 CXCR4 Receptor Antagonists CXCR4, CXCR1, CXCR2 NAPEPLD 2860/4885PIM1 2753/4885CHRM1 336/4885
US-20130289020-A1 CXCR4 Receptor Antagonists CXCR4, ACKR3, CXCR1 NAPEPLD 2243/4885PIM1 2351/4885CHRM1 1577/4885
US-10155761-B2 CXCR4 receptor antagonists CXCR4, CXCR1, CXCR2 NAPEPLD 2860/4885PIM1 2753/4885CHRM1 336/4885
US-20160046606-A1 CXCR4 Receptor Antagonists CXCR4, CXCR1, CXCR2 NAPEPLD 2860/4885PIM1 2753/4885CHRM1 336/4885
US-10995091-B2 CXCR4 receptor antagonists CXCR4, CXCR1, CXCR2 NAPEPLD 2860/4885PIM1 2753/4885CHRM1 336/4885

“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.