SCHEMBL16756359

SCHEMBL16756359

Cc1nc2cc(Cl)c(Br)cc2n1Cc1ccccc1OC(F)F

nearest known ligand 0.47

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
DCTPP1 Q9H773 3/20 0.43
GALR3 O60755 3/20 0.40
NR2F2 P24468 3/20 0.40
RAB9A P51151 2/20 0.40
NPC1 O15118 1/20 0.40
P2RX7 Q99572 2/20 0.39
PPARG P37231 1/20 0.38
TLR7 Q9NYK1 1/20 0.38
HTT P42858 2/20 0.37
MAPK1 P28482 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
TNF P01375 3/20 0.36
MAPT P10636 1/20 0.36
DHFR P00374 1/20 0.36
NPSR1 Q6W5P4 2/20 0.35
KDM4E B2RXH2 1/20 0.35
LMNA P02545 1/20 0.35

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
SCHEMBL16756257 0.88 TNF (0.47) DCTPP1GALR3NR2F2RAB9ANPC1
SCHEMBL15552701 0.84 GALR3 (0.46) GALR3NR2F2RAB9ANPC1TLR7
SCHEMBL16756239 0.82 TLR7 (0.40) DCTPP1GALR3NR2F2RAB9ANPC1
SCHEMBL18918981 0.82 TLR7 (0.42) DCTPP1GALR3NR2F2RAB9ANPC1
SCHEMBL28860467 0.81 GALR3 (0.62) GALR3NR2F2RAB9ANPC1HTT
SCHEMBL16756350 0.80 GALR3 (0.43) DCTPP1GALR3NR2F2RAB9ANPC1
SCHEMBL16756466 0.80 GALR3 (0.43) DCTPP1GALR3NR2F2RAB9ANPC1
SCHEMBL16756331 0.79 HPGD (0.40) DCTPP1GALR3NR2F2RAB9AHTT
SCHEMBL20258867 0.79 GALR3 (0.45) GALR3NR2F2RAB9ANPC1P2RX7
SCHEMBL16756298 0.79 TNF (0.42) DCTPP1GALR3NR2F2RAB9ANPC1

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
EP-2858983-B1 TNF-ALPHA MODULATING BENZIMIDAZOLES UCB BIOPHARMA SPRL (BE) 2018-04-18 EP disclosed
US-9550737-B2 TNF -α modulating benzimidazoles UCB BIOPHARMA SPRL (BE) 2017-01-24 US disclosed
US-20150152065-A1 TNF -Alpha Modulating Benzimidazoles UCB BIOPHARMA SPRL (BE) 2015-06-04 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-20150152065-A1 TNF -Alpha Modulating Benzimidazoles TNF, TNFRSF1A, NFKBIA DCTPP1 2186/4885GALR3 4147/4885NR2F2 4378/4885

“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.