SCHEMBL9911633

SCHEMBL9911633

O=C(NCCCCCCO)c1cc(-c2cccs2)on1

nearest known ligand 0.70

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 11/20 0.70
LMNA P02545 6/20 0.70
HPGD P15428 3/20 0.70
NPC1 O15118 8/20 0.67
MEN1 O00255 8/20 0.67
KMT2A Q03164 8/20 0.67
SMN1; SMN2 Q16637 6/20 0.67
HIF1A Q16665 1/20 0.65
KDM4E B2RXH2 3/20 0.65
NFKB1 P19838 1/20 0.65
NFKB2 Q00653 1/20 0.65
RELA Q04206 1/20 0.65
NPSR1 Q6W5P4 1/20 0.65
TSHR P16473 1/20 0.62
ALDH1A1 P00352 4/20 0.61
TP53 P04637 3/20 0.61
PLEC Q15149 1/20 0.61
MAPT P10636 1/20 0.59
ESR1 P03372 1/20 0.57
POLB P06746 2/20 0.56

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
SCHEMBL9911627 1.00 RAB9A (0.70) RAB9ALMNAHPGDNPC1MEN1
SCHEMBL17788442 0.99 RAB9A (0.72) RAB9ALMNAHPGDNPC1MEN1
SCHEMBL9911628 0.95 RAB9A (0.73) RAB9ALMNAHPGDNPC1MEN1
SCHEMBL20507246 0.90 RAB9A (0.67) RAB9ALMNAHPGDNPC1MEN1
SCHEMBL19000596 0.90 RAB9A (0.71) RAB9ALMNAHPGDNPC1MEN1
SCHEMBL9911645 0.90 RAB9A (0.77) RAB9ALMNAHPGDNPC1MEN1
SCHEMBL24305318 0.88 RAB9A (0.83) RAB9ALMNAHPGDNPC1MEN1
SCHEMBL14986237 0.88 RAB9A (0.61) RAB9ALMNAHPGDNPC1MEN1
SCHEMBL4283431 0.88 RAB9A (0.74) RAB9ALMNAHPGDNPC1MEN1
SCHEMBL17511092 0.88 RAB9A (0.70) RAB9ALMNAHPGDNPC1MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20170172987-A1 ISOXAZOLE TREATMENTS FOR FRONTOTEMPORAL DEMENTIA THE BOARD OF REGENTS OF THE UNIVERSITY OF TEXAS SYSTEM 2017-06-22 US disclosed
WO-2015143300-A1 ISOXAZOLE TREATMENTS FOR FRONTOTEMPORAL DEMENTIA THE BOARD OF REGENTS OF THE UNIVERSITY OF TEXAS SYSTEM (US) 2015-09-24 WO disclosed
US-20140364467-A1 CHEMICAL INDUCERS OF NEUROGENESIS THE BOARD OF REGENTS OF THE UNIVERSITY OF TEXAS SYSTEM (US) 2014-12-11 US disclosed
US-8778940-B2 Chemical inducers of neurogenesis THE BOARD OF REGENTS OF THE UNIVERSITY OF TEXAS SYSTEM (US) 2014-07-15 US disclosed
US-20130143885-A1 CHEMICAL INDUCERS OF NEUROGENESIS THE BOARD OF REGENTS OF THE UNIVERSITY OF TEXAS SYSTEM (US) 2013-06-06 US disclosed
US-8193225-B2 Isoxazole amides, derivatives and methods of chemical induction of neurogenesis THE BOARD OF REGENTS OF THE UNIVERSITY OF TEXAS SYSTEM (US) 2012-06-05 US disclosed
US-8193225-B2 Isoxazole amides, derivatives and methods of chemical induction of neurogenesis THE BOARD OF REGENTS OF THE UNIVERSITY OF TEXAS SYSTEM (US) 2012-06-05 US disclosed
US-20090036451-A1 Chemical inducers of neurogenesis THE BOARD OF REGENTS OF THE UNIVERSITY OF TEXAS SYSTEM 2009-02-05 US disclosed
US-20090036451-A1 Chemical inducers of neurogenesis THE BOARD OF REGENTS OF THE UNIVERSITY OF TEXAS SYSTEM 2009-02-05 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 (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-20170172987-A1 ISOXAZOLE TREATMENTS FOR FRONTOTEMPORAL DEMENTIA GRN, PSEN1, PSEN2 RAB9A 4377/4885LMNA 753/4885HPGD 327/4885
US-20140364467-A1 CHEMICAL INDUCERS OF NEUROGENESIS DCX, NES, GAP43 RAB9A 2878/4885LMNA 3120/4885HPGD 289/4885
US-20090036451-A1 Chemical inducers of neurogenesis DCX, NES, GAP43 RAB9A 2878/4885LMNA 3120/4885HPGD 289/4885
US-20130143885-A1 CHEMICAL INDUCERS OF NEUROGENESIS DCX, NES, GAP43 RAB9A 2878/4885LMNA 3120/4885HPGD 289/4885

“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.