SCHEMBL2010247

SCHEMBL2010247

O=C(CC(=O)Nc1ccccc1F)Nc1ccccc1F

nearest known ligand 0.69

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 3/20 0.69
NPC1 O15118 3/20 0.69
RAB9A P51151 3/20 0.69
ALDH1A1 P00352 3/20 0.68
MAPT P10636 2/20 0.68
GAA P10253 1/20 0.68
POLB P06746 3/20 0.62
TSHR P16473 3/20 0.62
HTT P42858 2/20 0.58
NPSR1 Q6W5P4 1/20 0.57
PKM P14618 1/20 0.57
MEN1 O00255 1/20 0.56
KMT2A Q03164 1/20 0.56
HPGD P15428 1/20 0.55

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
SCHEMBL2605749 0.91 KMT2A (0.63) SMN1; SMN2NPC1RAB9AALDH1A1MAPT
SCHEMBL19027028 0.91 SMN1; SMN2 (0.58) SMN1; SMN2NPC1RAB9AALDH1A1MAPT
SCHEMBL307626 0.90 NPC1 (0.65) SMN1; SMN2NPC1RAB9AALDH1A1MAPT
SCHEMBL7141238 0.88 ALDH1A1 (0.60) SMN1; SMN2NPC1RAB9AALDH1A1MAPT
SCHEMBL3990399 0.88 SMN1; SMN2 (0.60) SMN1; SMN2NPC1RAB9AALDH1A1MAPT
SCHEMBL7982548 0.88 SMN1; SMN2 (0.64) SMN1; SMN2NPC1RAB9AALDH1A1MAPT
SCHEMBL19027027 0.88 SMN1; SMN2 (0.55) SMN1; SMN2NPC1RAB9AALDH1A1MAPT
SCHEMBL10172305 0.86 SMN1; SMN2 (0.55) SMN1; SMN2NPC1RAB9AALDH1A1MAPT
SCHEMBL1431346 0.86 NPC1 (0.62) SMN1; SMN2NPC1RAB9AALDH1A1MAPT
SCHEMBL5804013 0.86 SMN1; SMN2 (0.62) SMN1; SMN2NPC1RAB9AALDH1A1MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7964625-B2 Antibiotics comprising bis(1-aryl-5-tetrazoly1)methane derivatives NEDERLANDSE ORGANISATIE VOOR TOEGEPAST-NATUURWETENSCHAPPELIJK ONDERZOEK TNO (NL) 2011-06-21 US disclosed
EP-1937257-B1 NOVEL ANTIBIOTICS COMPRISING BIS(1-ARYL-5-TETRAZ0LYL)METHANE DERIVATIVES TNO (NL) 2010-12-08 EP disclosed
US-20080280964-A1 Novel Antibiotics Comprising Bis(1-Aryl-5-Tetrazolyl)Methane Derivatives NEDERLANDSE ORGANISATIE VOOR TOEGEPAST- NATUURWETENSCHAPPELIJK ONDERZOEK TNO (NL) 2008-11-13 US disclosed
US-5338642-A Diazo type recording material comprising two couplers wherein the novel coupler used is a bis-malonamide FUJI PHOTO FILM CO., LTD. (JP) 1994-08-16 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-20080280964-A1 Novel Antibiotics Comprising Bis(1-Aryl-5-Tetrazolyl)Methane Derivatives LAS1L, AAAS, RPS5 SMN1; SMN2 3985/4885NPC1 2947/4885RAB9A 1928/4885

“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.