SCHEMBL13020475

SCHEMBL13020475

CN(C)/C=N/c1ncnc2c1c(-c1ccc(Cl)cc1)nn2C(=O)NCc1ccccc1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ NPSR1 Q6W5P4 2/20 0.41
▸ CA1 P00915 1/20 0.40
▸ CA2 P00918 1/20 0.40
▸ CA4 P22748 1/20 0.40
▸ CA9 Q16790 1/20 0.40
▸ CNR1 P21554 2/20 0.39
▸ MAPT P10636 1/20 0.38
▸ SRC P12931 1/20 0.37
▸ KDM4E B2RXH2 3/20 0.36
▸ ALDH1A1 P00352 3/20 0.36
▸ HTT P42858 2/20 0.36
▸ RAB9A P51151 2/20 0.36
▸ LMNA P02545 1/20 0.36
▸ F2 P00734 1/20 0.36
▸ BTK Q06187 2/20 0.36
▸ MEN1 O00255 1/20 0.36
▸ NPC1 O15118 1/20 0.36
▸ POLB P06746 1/20 0.36
▸ HPGD P15428 1/20 0.36
▸ TSHR P16473 1/20 0.36

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
SCHEMBL3777826 0.88 MAPT (0.41) NPSR1CA1CA2CA4CA9
SCHEMBL3777832 0.88 MAPT (0.41) NPSR1CA1CA2CA4CA9
SCHEMBL3781508 0.81 SRC (0.58) SRCBTKMEN1KMT2ASMN1; SMN2
SCHEMBL3790754 0.79 ALDH1A1 (0.43) NPSR1CA1CA2CA9CNR1
SCHEMBL3788895 0.72 SRC (0.61) NPSR1MAPTSRCKDM4EALDH1A1
SCHEMBL3788898 0.72 SRC (0.61) NPSR1MAPTSRCKDM4EALDH1A1
SCHEMBL13019972 0.72 SRC (0.61) NPSR1MAPTSRCKDM4EALDH1A1
SCHEMBL13020471 0.71 CNR1 (0.44) NPSR1CNR1MAPTSRCALDH1A1
SCHEMBL3779241 0.69 SRC (0.55) SRCKDM4EALDH1A1HTTBTK
SCHEMBL13307728 0.68 CNR1 (0.58) NPSR1CNR1ALDH1A1RAB9ALMNA

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-20100331297-A1 MODULATION OF PROTEIN TRAFFICKING FOLDRX PHARMACEUTICALS, INC. (US) 2010-12-30 — — US disclosed
US-20100331297-A1 MODULATION OF PROTEIN TRAFFICKING FOLDRX PHARMACEUTICALS, INC. (US) 2010-12-30 — — 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-20100331297-A1 MODULATION OF PROTEIN TRAFFICKING RAB1A, COPB1, GOLT1B NPSR1 2247/4885CA1 4771/4885CA2 4689/4885

“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.

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