SCHEMBL9921228

SCHEMBL9921228

CCC(C)OCCCN1CCCC1=O

nearest known ligand 0.47

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ PIK3CD O00329 1/20 0.47
▸ SMN1; SMN2 Q16637 2/20 0.43
▸ KMT2A Q03164 3/20 0.40
▸ MEN1 O00255 2/20 0.40
▸ PKM P14618 1/20 0.40
▸ ALDH1A1 P00352 2/20 0.39
▸ MAPT P10636 1/20 0.39
▸ RAB9A P51151 1/20 0.39
▸ PGK1 P00558 1/20 0.39
▸ ADRA1B P35368 2/20 0.39
▸ KDM4E B2RXH2 1/20 0.38
▸ HSD17B10 Q99714 1/20 0.38
▸ MALT1 Q9UDY8 1/20 0.38
▸ L3MBTL1 Q9Y468 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
SCHEMBL9917278 0.86 PIK3CD (0.51) PIK3CDSMN1; SMN2KMT2AMEN1PKM
SCHEMBL9917276 0.81 PIK3CD (0.46) PIK3CDSMN1; SMN2KMT2AMEN1PKM
SCHEMBL4581970 0.77 L3MBTL1 (0.48) PIK3CDSMN1; SMN2KMT2AMEN1PKM
SCHEMBL8524128 0.77 PIK3CD (0.46) PIK3CDSMN1; SMN2KMT2AMEN1PKM
SCHEMBL1978043 0.76 PIK3CD (0.51) PIK3CDSMN1; SMN2KMT2AMEN1PKM
SCHEMBL9126070 0.76 SMN1; SMN2 (0.45) PIK3CDSMN1; SMN2KMT2AMEN1ALDH1A1
SCHEMBL14488847 0.76 PIK3CD (0.47) PIK3CDSMN1; SMN2KMT2AMEN1PKM
SCHEMBL9917277 0.76 PIK3CD (0.55) PIK3CDKMT2AMEN1PKMALDH1A1
SCHEMBL1635359 0.75 PIK3CD (0.41) PIK3CDSMN1; SMN2KMT2AMEN1ALDH1A1
SCHEMBL10513 0.75 PIK3CD (0.52) PIK3CDSMN1; SMN2KMT2AMEN1PKM

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-20120148534-A1 METHODS AND COMPOSITIONS OF TREATING A FLAVIVIRIDAE FAMILY VIRAL INFECTION NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2012-06-14 — — US disclosed
US-20100015093-A1 Methods and compositions of treating a flaviviridae family viral infection THE BOARD OF TRUSTEES OF THE LELAND STANFORD JUNIOR UNIVERSITY 2010-01-21 — — 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 (2 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-20120148534-A1 METHODS AND COMPOSITIONS OF TREATING A FLAVIVIRIDAE FAMILY VIRAL INFECTION EIF2AK2, NSUN3, NSUN2 PIK3CD 2405/4885SMN1; SMN2 2247/4885KMT2A 2858/4885
US-20100015093-A1 Methods and compositions of treating a flaviviridae family viral infection EIF2AK2, NSUN3, NSUN2 PIK3CD 2405/4885SMN1; SMN2 2247/4885KMT2A 2858/4885

“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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