SCHEMBL19954876

SCHEMBL19954876

Cc1cccc2c(C(C)C)nn(C)c12

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SSTR4 P31391 4/20 0.50
ADORA3 P0DMS8 1/20 0.41
ADORA1 P30542 1/20 0.41
ALKBH5 Q6P6C2 1/20 0.41
FTO Q9C0B1 1/20 0.41
MEN1 O00255 1/20 0.38
NPC1 O15118 1/20 0.38
HCRTR1 O43613 1/20 0.38
RAB9A P51151 1/20 0.38
KMT2A Q03164 1/20 0.38
CYP1A2 P05177 1/20 0.37
CYP2A6 P11509 1/20 0.37
SSTR1 P30872 1/20 0.36
ESR1 P03372 1/20 0.35
LMNA P02545 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
SLC22A12 Q96S37 1/20 0.35
NAMPT P43490 2/20 0.35
KAT2B Q92831 3/20 0.33
CASR P41180 1/20 0.33

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
SCHEMBL16256072 0.86 SSTR4 (0.48) SSTR4ALKBH5FTOMEN1NPC1
SCHEMBL23979724 0.81 ADORA3 (0.40) SSTR4ADORA3ADORA1SSTR1ESR1
SCHEMBL31582863 0.81 ADORA3 (0.40) SSTR4ADORA3ADORA1LMNASMN1; SMN2
SCHEMBL20215514 0.77 ALKBH5 (0.46) SSTR4ALKBH5FTOMEN1NPC1
SCHEMBL15687376 0.77 ADORA3 (0.38) SSTR4ADORA3ADORA1NPC1RAB9A
SCHEMBL23809387 0.76 DHODH (0.42) SSTR4ADORA3ADORA1RAB9ALMNA
SCHEMBL16006573 0.74 ALKBH5 (0.43) SSTR4ADORA3ALKBH5FTOMEN1
SCHEMBL20389071 0.74 ALKBH5 (0.43) SSTR4ALKBH5FTOMEN1NPC1
SCHEMBL15687391 0.72 NR4A2 (0.41) SSTR4ADORA3ADORA1MEN1KMT2A
SCHEMBL31575344 0.72 SOS2 (0.46) SSTR4ADORA1ALKBH5FTOMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20210347807-A1 URIDINE DIPHOSPHATE DERIVATIVES, COMPOSITIONS AND METHODS FOR TREATING NEURODEGENERATIVE DISORDERS UNIV TUFTS (US) 2021-11-11 US disclosed
US-9913855-B2 Uridine diphosphate derivatives, prodrugs, compositions and uses thereof TUFTS UNIVERSITY (US) 2018-03-13 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 (1 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-20210347807-A1 URIDINE DIPHOSPHATE DERIVATIVES, COMPOSITIONS AND METHODS FOR TREATING NEURODEGENERATIVE DISORDERS P2RY6, P2RX6, P2RY1 SSTR4 4229/4885ADORA3 27/4885ADORA1 32/4885

“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.