SCHEMBL12412604

SCHEMBL12412604

CC(=O)N(C)CCCc1ccncc1

nearest known ligand 0.43

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.43
HRH1 P35367 2/20 0.42
TSHR P16473 1/20 0.39
CYP1A2 P05177 1/20 0.39
CYP3A4 P08684 1/20 0.39
CYP2D6 P10635 1/20 0.39
CYP2C9 P11712 1/20 0.39
CYP2C19 P33261 1/20 0.39
NPC1 O15118 2/20 0.39
RAB9A P51151 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
LOXL2 Q9Y4K0 1/20 0.38
KMT2A Q03164 1/20 0.38
TRPV1 Q8NER1 1/20 0.38

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
SCHEMBL4387675 0.89 CYP1A2 (0.45) TSHRCYP1A2CYP3A4CYP2D6CYP2C9
Oxalic Acid SCHEMBL11178022 0.85 CYP1A2 (0.45) TSHRCYP1A2CYP3A4CYP2D6CYP2C9
SCHEMBL12277755 0.81 CHRNA7 (0.57) LMNAHRH1KMT2ATRPV1
SCHEMBL6413794 0.79 TAAR1 (0.52) LMNAKMT2A
SCHEMBL9546454 0.78 ALDH1A1 (0.54) TSHRNPC1RAB9ASMN1; SMN2KMT2A
SCHEMBL7092468 0.77 SIGMAR1 (0.53) LMNAHRH1LOXL2
SCHEMBL10568746 0.76 SMN1; SMN2 (0.50) LMNATSHRNPC1SMN1; SMN2
SCHEMBL16658701 0.76 SIGMAR1 (0.62)
SCHEMBL16658699 0.76 SIGMAR1 (0.62)
SCHEMBL16658700 0.76 SIGMAR1 (0.62)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20180221279-A1 MODIFIED DRUGS FOR USE IN LIPOSOMAL NANOPARTICLES UNIV BRITISH COLUMBIA (CA) 2018-08-09 US disclosed
US-9968554-B2 Modified drugs for use in liposomal nanoparticles THE UNIVERSITY OF BRITISH COLUMBIA (CA) 2018-05-15 US disclosed
US-20140356417-A1 MODIFIED DRUGS FOR USE IN LIPOSOMAL NANOPARTICLES THE UNIVERSITY OF BRITISH COLUMBIA (CA) 2014-12-04 US disclosed
US-8790691-B2 Modified drugs for use in liposomal nanoparticles THE UNIVERSITY OF BRITISH COLUMBIA (CA) 2014-07-29 US disclosed
US-8568772-B2 Modified drugs for use in liposomal nanoparticles THE UNIVERSITY OF BRITISH COLUMBIA (CA) 2013-10-29 US disclosed
US-8545877-B2 Modified drugs for use in liposomal nanoparticles UNIVERSITY OF BRITISH COLUMBIA (CA) 2013-10-01 US disclosed
US-8545876-B1 Modified drugs for use in liposomal nanoparticles UNIVERSITY OF BRITISH COLUMBIA (CA) 2013-10-01 US disclosed
US-20130236534-A1 MODIFIED DRUGS FOR USE IN LIPOSOMAL NANOPARTICLES UNIV BRITISH COLUMBIA (CA) 2013-09-12 US disclosed
US-20130230582-A1 MODIFIED DRUGS FOR USE IN LIPOSOMAL NANOPARTICLES UNIV BRITISH COLUMBIA (CA) 2013-09-05 US disclosed
US-20130230583-A1 MODIFIED DRUGS FOR USE IN LIPOSOMAL NANOPARTICLES UNIV BRITISH COLUMBIA (CA) 2013-09-05 US disclosed
US-8324410-B2 Modified drugs for use in liposomal nanoparticles THE UNIVERSITY OF BRITISH COLUMBIA (CA) 2012-12-04 US disclosed
US-20120237591-A1 MODIFIED DRUGS FOR USE IN LIPOSOMAL NANOPARTICLES THE UNIVERSITY OF BRITISH COLUMBIA (CA) 2012-09-20 US disclosed
US-20110165225-A1 Modified Drugs for Use in Liposomal Nanoparticles THE UNIVERSITY OF BRITISH COLUMBIA (CA) 2011-07-07 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 (7 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-20130230582-A1 MODIFIED DRUGS FOR USE IN LIPOSOMAL NANOPARTICLES ABCB11, ABCB1, SLC43A1 LMNA 153/4885HRH1 2015/4885TSHR 3093/4885
US-20110165225-A1 Modified Drugs for Use in Liposomal Nanoparticles ABCB11, SLC47A1, ABCB1 LMNA 117/4885HRH1 2985/4885TSHR 2672/4885
US-20120237591-A1 MODIFIED DRUGS FOR USE IN LIPOSOMAL NANOPARTICLES ABCB11, ABCB1, SLC43A1 LMNA 153/4885HRH1 2015/4885TSHR 3093/4885
US-20130236534-A1 MODIFIED DRUGS FOR USE IN LIPOSOMAL NANOPARTICLES ABCB11, ABCB1, SLC43A1 LMNA 153/4885HRH1 2015/4885TSHR 3093/4885
US-20130230583-A1 MODIFIED DRUGS FOR USE IN LIPOSOMAL NANOPARTICLES ABCB11, ABCB1, SLC43A1 LMNA 153/4885HRH1 2015/4885TSHR 3093/4885
US-20180221279-A1 MODIFIED DRUGS FOR USE IN LIPOSOMAL NANOPARTICLES ABCB11, SLC47A1, ABCB1 LMNA 117/4885HRH1 2985/4885TSHR 2672/4885
US-20140356417-A1 MODIFIED DRUGS FOR USE IN LIPOSOMAL NANOPARTICLES ABCB11, SLC47A1, ABCB1 LMNA 117/4885HRH1 2985/4885TSHR 2672/4885

“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.