SCHEMBL4447240

SCHEMBL4447240

NC(=O)Cc1cccc(-c2nnc(Cc3cccc(-c4nn[nH]n4)c3)o2)c1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HPGD P15428 2/20 0.43
▸ TSHR P16473 2/20 0.43
▸ SMN1; SMN2 Q16637 2/20 0.43
▸ LMNA P02545 1/20 0.43
▸ TP53 P04637 1/20 0.43
▸ NPC1 O15118 1/20 0.42
▸ RAB9A P51151 1/20 0.42
▸ GPR55 Q9Y2T6 1/20 0.42
▸ HDAC6 Q9UBN7 1/20 0.41
▸ PTGDR2 Q9Y5Y4 3/20 0.41
▸ MAPT P10636 1/20 0.41
▸ GP6 Q9HCN6 1/20 0.40
▸ CTSD P07339 2/20 0.39
▸ F7 P08709 1/20 0.39
▸ F3 P13726 1/20 0.39
▸ IDO1 P14902 1/20 0.39
▸ MRGPRX4 Q96LA9 1/20 0.39
▸ ALDH1A1 P00352 1/20 0.38
▸ FAAH O00519 1/20 0.38
▸ MGLL Q99685 1/20 0.38

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
SCHEMBL4447249 0.84 NPC1 (0.45) HPGDTSHRSMN1; SMN2LMNATP53
SCHEMBL4449842 0.78 TSHR (0.48) HPGDTSHRSMN1; SMN2LMNATP53
SCHEMBL30004856 0.67 PFKFB3 (0.60) NPC1RAB9AMAPTGP6IDO1
SCHEMBL2856871 0.67 PFKFB3 (0.60) NPC1RAB9AMAPTGP6IDO1
SCHEMBL10066157 0.66 TP53 (0.65) TP53PTGDR2MAPTGP6IDO1
SCHEMBL28274779 0.66 SMN1; SMN2 (0.62) HPGDTSHRSMN1; SMN2LMNANPC1
SCHEMBL4445945 0.65 XDH (0.44) PIK3CDPIK3CAPIK3CBPIK3CG
SCHEMBL27517650 0.64 KMO (0.54) HPGDTSHRSMN1; SMN2LMNANPC1
SCHEMBL940146 0.63 GP6 (0.65) NPC1RAB9APTGDR2MAPTGP6
SCHEMBL16163063 0.63 PTGDR2 (0.41) PTGDR2MAPTGP6CTSDIDO1

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-20090275583-A1 ANTIVIRAL COMPOUNDS AND USE THEREOF MYRIAD GENETICS, INCORPORATED (US) 2009-11-05 — — US disclosed
WO-2008127364-A2 ANTIVIRAL COMPOUNDS AND USE THEREOF MYRIAD GENETICS, INC. (US) 2008-10-23 — — 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-20090275583-A1 ANTIVIRAL COMPOUNDS AND USE THEREOF MAVS, ZC3HAV1, EIF2AK2 HPGD 2528/4885TSHR 4811/4885SMN1; SMN2 1983/4885

“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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