SCHEMBL9911642

SCHEMBL9911642

CCONC(=O)c1cc(-c2cccs2)on1

nearest known ligand 0.67

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 6/20 0.67
SMN1; SMN2 Q16637 6/20 0.67
NPC1 O15118 4/20 0.67
LMNA P02545 5/20 0.65
HPGD P15428 3/20 0.65
KDM4E B2RXH2 5/20 0.62
MAPT P10636 5/20 0.62
TP53 P04637 3/20 0.62
THRB P10828 1/20 0.62
KMT2A Q03164 10/20 0.62
MEN1 O00255 9/20 0.62
ALDH1A1 P00352 6/20 0.59
NPSR1 Q6W5P4 2/20 0.59
HTT P42858 1/20 0.59
ESR1 P03372 1/20 0.58
POLB P06746 3/20 0.57
HSD17B10 Q99714 2/20 0.57
PLEC Q15149 1/20 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
SCHEMBL9911638 0.85 RAB9A (0.71) RAB9ASMN1; SMN2NPC1LMNAHPGD
SCHEMBL4282973 0.83 RAB9A (0.74) RAB9ASMN1; SMN2NPC1LMNAHPGD
SCHEMBL9911623 0.81 RAB9A (0.72) RAB9ASMN1; SMN2NPC1LMNAHPGD
SCHEMBL4281968 0.81 RAB9A (0.77) RAB9ASMN1; SMN2NPC1LMNAHPGD
SCHEMBL508571 0.80 KMT2A (0.61) RAB9ASMN1; SMN2NPC1LMNAHPGD
SCHEMBL4289004 0.80 RAB9A (1.00) RAB9ASMN1; SMN2NPC1LMNAHPGD
SCHEMBL9911643 0.79 RAB9A (0.70) RAB9ASMN1; SMN2NPC1LMNAHPGD
SCHEMBL4284351 0.79 RAB9A (1.00) RAB9ASMN1; SMN2NPC1LMNAHPGD
SCHEMBL4283077 0.79 RAB9A (0.74) RAB9ASMN1; SMN2NPC1LMNAHPGD
SCHEMBL4283431 0.79 RAB9A (0.74) RAB9ASMN1; SMN2NPC1LMNAHPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2023109779-A1 USE OF HETEROCYCLIC COMPOUND IN REDUCING ADVERSE REACTIONS CAUSED BY CHEMOTHERAPEUTIC DRUGS 清华大学 2023-06-22 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 (3 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-20140364467-A1 CHEMICAL INDUCERS OF NEUROGENESIS DCX, NES, GAP43 RAB9A 2878/4885SMN1; SMN2 929/4885NPC1 1941/4885
US-20090036451-A1 Chemical inducers of neurogenesis DCX, NES, GAP43 RAB9A 2878/4885SMN1; SMN2 929/4885NPC1 1941/4885
US-20130143885-A1 CHEMICAL INDUCERS OF NEUROGENESIS DCX, NES, GAP43 RAB9A 2878/4885SMN1; SMN2 929/4885NPC1 1941/4885

“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.