SCHEMBL424291

SCHEMBL424291

O=C(N1CCCc2ccccc21)n1cnc(-c2ccccc2)c1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RECQL P46063 2/20 0.55
LMNA P02545 2/20 0.55
SMN1; SMN2 Q16637 1/20 0.52
MAPT P10636 4/20 0.52
ALDH1A1 P00352 3/20 0.52
RAB9A P51151 1/20 0.52
NPSR1 Q6W5P4 4/20 0.51
ATM Q13315 1/20 0.51
NOTUM Q6P988 1/20 0.50
POLB P06746 1/20 0.49
AVPR2 P30518 1/20 0.49
OXTR P30559 1/20 0.49
AVPR1A P37288 1/20 0.49
PDE4B Q07343 1/20 0.48
KMT2A Q03164 3/20 0.48
HTT P42858 2/20 0.48
MEN1 O00255 2/20 0.48
MAPK1 P28482 1/20 0.48
KDM4E B2RXH2 1/20 0.47
TSHR P16473 2/20 0.47

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
SCHEMBL424298 0.91 ALDH1A1 (0.55) RECQLLMNASMN1; SMN2MAPTALDH1A1
SCHEMBL425435 0.90 SMN1; SMN2 (0.47) RECQLLMNASMN1; SMN2MAPTALDH1A1
SCHEMBL425419 0.86 ALDH1A1 (0.59) LMNASMN1; SMN2MAPTALDH1A1RAB9A
SCHEMBL4019697 0.77 SMN1; SMN2 (0.79) SMN1; SMN2MAPTALDH1A1NPSR1NOTUM
SCHEMBL425650 0.75 HPGD (0.53) LMNASMN1; SMN2MAPTALDH1A1RAB9A
SCHEMBL1855923 0.74 SMN1; SMN2 (0.57) SMN1; SMN2MAPTALDH1A1NPSR1NOTUM
SCHEMBL29353444 0.72 SMN1; SMN2 (0.77) RECQLSMN1; SMN2MAPTALDH1A1NPSR1
SCHEMBL2829456 0.72 SMN1; SMN2 (0.77) RECQLSMN1; SMN2MAPTALDH1A1NPSR1
SCHEMBL29598114 0.71 AVPR2 (0.59) RECQLLMNAMAPTALDH1A1RAB9A
Hydrochloric Acid SCHEMBL11845665 0.71 SMN1; SMN2 (0.74) RECQLSMN1; SMN2MAPTALDH1A1NPSR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9353082-B2 Pharmaceutical compounds BIAL—PORTELA & CA, S.A. (PT) 2016-05-31 US disclosed
US-9353082-B2 Pharmaceutical compounds BIAL—PORTELA & CA, S.A. (PT) 2016-05-31 US disclosed
US-9353082-B2 Pharmaceutical compounds BIAL—PORTELA & CA, S.A. (PT) 2016-05-31 US disclosed
US-20120065191-A1 PHARMACEUTICAL COMPOUNDS BIAL - PORTELA & Cª, S.A. (PT) 2012-03-15 US disclosed
US-20120065191-A1 PHARMACEUTICAL COMPOUNDS BIAL - PORTELA & Cª, S.A. (PT) 2012-03-15 US disclosed
US-20120065191-A1 PHARMACEUTICAL COMPOUNDS BIAL - PORTELA & Cª, S.A. (PT) 2012-03-15 US disclosed
WO-2010074588-A2 PHARMACEUTICAL COMPOUNDS BIAL - PORTELA & Cª, S.A. (PT) 2010-07-01 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-20120065191-A1 PHARMACEUTICAL COMPOUNDS FAAH, FAAH2, ASAH1 RECQL 1847/4885LMNA 2523/4885SMN1; SMN2 2818/4885

“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.