SCHEMBL22319949

SCHEMBL22319949

C=Cc1cccc(C2CCCc3ccccc32)c1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GID4 Q8IVV7 1/20 0.59
IGF1R P08069 1/20 0.44
ALOX15 P16050 1/20 0.44
TAS1R3 Q7RTX0 1/20 0.44
TAS1R1 Q7RTX1 1/20 0.44
ADRA2A P08913 2/20 0.42
ADRA1A P35348 2/20 0.42
CYP2D6 P10635 2/20 0.42
ADRA1D P25100 1/20 0.42
ADRA1B P35368 1/20 0.42
HTR1A P08908 1/20 0.42
OPRM1 P35372 1/20 0.42
HAO1 Q9UJM8 1/20 0.41
TAAR1 Q96RJ0 2/20 0.41
MEN1 O00255 1/20 0.41
ALDH1A1 P00352 1/20 0.41
BLM P54132 1/20 0.41
KMT2A Q03164 1/20 0.41
MAPK1 P28482 1/20 0.41
MAPK14 Q16539 1/20 0.41

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
SCHEMBL22332685 0.80 GID4 (0.41) GID4IGF1RALOX15TAS1R3TAS1R1
SCHEMBL395087 0.78 GID4 (0.62) GID4IGF1RALOX15ADRA2AADRA1A
SCHEMBL29842306 0.78 GID4 (0.62) GID4IGF1RALOX15ADRA2AADRA1A
SCHEMBL20856064 0.78 GID4 (0.63) GID4IGF1RALOX15ADRA2AADRA1A
SCHEMBL7075150 0.78 GID4 (0.63) GID4IGF1RALOX15ADRA2AADRA1A
SCHEMBL27491947 0.78 GID4 (0.63) GID4IGF1RALOX15ADRA2AADRA1A
SCHEMBL20863607 0.74 GID4 (1.00) GID4MEN1ALDH1A1KMT2AMAPK1
SCHEMBL27513579 0.74 GID4 (0.70) GID4IGF1RALOX15ADRA2AADRA1A
SCHEMBL24894731 0.73 GID4 (0.58) GID4IGF1RALOX15TAS1R3TAS1R1
SCHEMBL22319970 0.73 GID4 (0.61) GID4IGF1RALOX15ADRA2AADRA1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20200253996-A1 TCTP INHIBITING AGENTS FOR THE TREATMENT OF PROLIFERATIVE DISEASES, INFECTIOUS DISEASES, ALLERGIES, INFLAMMATIONS AND/OR ASTHMA UNIVERSITE PARIS-SUD (FR) 2020-08-13 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-20200253996-A1 TCTP INHIBITING AGENTS FOR THE TREATMENT OF PROLIFERATIVE DISEASES, INFECTIOUS DISEASES, ALLERGIES, INFLAMMATIONS AND/OR ASTHMA NR3C1, TSLP, FPR3 GID4 2937/4885IGF1R 2829/4885ALOX15 814/4885

“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.