SCHEMBL22353121

SCHEMBL22353121

Nc1ccc(-c2[nH]nnc2-c2ccccc2)cc1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 5/20 0.49
KDM4E B2RXH2 5/20 0.49
NPC1 O15118 4/20 0.49
ALDH1A1 P00352 4/20 0.49
HPGD P15428 4/20 0.49
HSD17B10 Q99714 3/20 0.49
SMN1; SMN2 Q16637 3/20 0.49
GAA P10253 2/20 0.49
CYP3A4 P08684 3/20 0.48
TAAR1 Q96RJ0 1/20 0.48
TDP1 Q9NUW8 1/20 0.48
KMT2A Q03164 5/20 0.46
MEN1 O00255 4/20 0.46
MAPT P10636 3/20 0.44
GLA P06280 1/20 0.44
ALOX15 P16050 1/20 0.44
CYP1A2 P05177 1/20 0.44
CYP2D6 P10635 1/20 0.44
CYP2C9 P11712 1/20 0.44
CYP2C19 P33261 1/20 0.44

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
SCHEMBL453506 0.89 KDM4E (0.48) RAB9AKDM4ENPC1ALDH1A1HPGD
SCHEMBL28264084 0.82 TDP1 (0.50) RAB9AKDM4ENPC1ALDH1A1HPGD
SCHEMBL28266659 0.82 LMNA (0.50) RAB9AKDM4ENPC1ALDH1A1HPGD
SCHEMBL28270530 0.82 MAPK13 (0.54) RAB9AKDM4ENPC1ALDH1A1HPGD
SCHEMBL28116018 0.82 TDP1 (0.50) RAB9AKDM4ENPC1ALDH1A1HPGD
SCHEMBL28147084 0.81 TAAR1 (0.53) RAB9AKDM4ENPC1ALDH1A1HPGD
Phenol SCHEMBL28258861 0.80 RPS6KA3 (0.45) RAB9AKDM4ENPC1ALDH1A1HPGD
SCHEMBL28115678 0.79 LTA4H (0.46) RAB9AKDM4ENPC1ALDH1A1HPGD
SCHEMBL28757943 0.78 CNR1 (0.45) RAB9AKDM4ENPC1ALDH1A1HPGD
SCHEMBL28036308 0.78 KDM4E (0.54) RAB9AKDM4ENPC1ALDH1A1HPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11161835-B2 Compounds and their use for reducing uric acid levels ACQUIST LLC (US) 2021-11-02 US disclosed
US-20200339545-A1 Compounds And Their Use For Reducing Uric Acid Levels ACQUIST LLC (US) 2020-10-29 US disclosed
US-10752613-B2 Compounds and their use for reducing uric acid levels ACQUIST LLC (US) 2020-08-25 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-20200339545-A1 Compounds And Their Use For Reducing Uric Acid Levels XDH, OAT, PON1 RAB9A 2502/4885KDM4E 4498/4885NPC1 790/4885
US-11161835-B2 Compounds and their use for reducing uric acid levels XDH, OAT, PON1 RAB9A 2502/4885KDM4E 4498/4885NPC1 790/4885
US-10752613-B2 Compounds and their use for reducing uric acid levels XDH, OAT, PON1 RAB9A 2502/4885KDM4E 4498/4885NPC1 790/4885

“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.