SCHEMBL20715331

SCHEMBL20715331

Clc1ccc(Cn2c(Nc3ccccc3)nc3ccccc32)cc1

nearest known ligand 0.69

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 3/20 0.69
TBXA2R P21731 3/20 0.69
MAPT P10636 2/20 0.66
NOD1 Q9Y239 4/20 0.63
ALDH1A1 P00352 4/20 0.60
NOD2 Q9HC29 3/20 0.60
KDM4E B2RXH2 2/20 0.60
RAB9A P51151 2/20 0.59
TNF P01375 1/20 0.59
CXCL8 P10145 1/20 0.59
SOS1 Q07889 1/20 0.59
GALR3 O60755 1/20 0.59
NR2F2 P24468 1/20 0.59
GAA P10253 1/20 0.58
MEN1 O00255 1/20 0.56
HPGD P15428 1/20 0.56
TSHR P16473 1/20 0.56
KMT2A Q03164 1/20 0.56
NPSR1 Q6W5P4 1/20 0.56
HSD17B10 Q99714 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
SCHEMBL28771058 0.83 ALDH1A1 (0.71) DRD2TBXA2RMAPTALDH1A1KDM4E
SCHEMBL27898218 0.83 ALDH1A1 (0.76) DRD2TBXA2RMAPTNOD1ALDH1A1
SCHEMBL27915822 0.83 ALDH1A1 (0.76) DRD2TBXA2RMAPTNOD1ALDH1A1
SCHEMBL1170123 0.83 SMN1; SMN2 (0.74) DRD2TBXA2RMAPTNOD1ALDH1A1
SCHEMBL20715451 0.81 NOD2 (0.67) DRD2TBXA2RMAPTNOD1ALDH1A1
SCHEMBL17465144 0.79 P2RX3 (0.70) DRD2TBXA2R
SCHEMBL15180676 0.78 P2RX3 (0.68)
SCHEMBL8734474 0.77 NOD1 (0.70) DRD2TBXA2RNOD1ALDH1A1NOD2
SCHEMBL28490322 0.77 MAPT (0.85) DRD2TBXA2RMAPTALDH1A1KDM4E
SCHEMBL4097969 0.77 NOD1 (0.71) DRD2TBXA2RMAPTNOD1ALDH1A1

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-20200377505-A1 BENZIMIDAZOLES AND AZA-BENZIMIDAZOLES, AND METHODS OF USE THEREOF GFB (ABC), LLC 2020-12-03 US disclosed
WO-2019028308-A1 BENZIMIDAZOLES AND AZA-BENZIMIDAZOLES, AND METHODS OF USE THEREOF GOLDFINCH BIO, INC. (US) 2019-02-07 WO 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-20200377505-A1 BENZIMIDAZOLES AND AZA-BENZIMIDAZOLES, AND METHODS OF USE THEREOF AZI2, ATP6V1B1, GLS DRD2 2400/4885TBXA2R 362/4885MAPT 4542/4885

“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.