SCHEMBL6192276

SCHEMBL6192276

N#CC1C=Cc2c(F)cccc2N1C(=O)c1ccccc1

nearest known ligand 0.56

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 4/20 0.56
▸ SMN1; SMN2 Q16637 4/20 0.56
▸ KMT2A Q03164 8/20 0.52
▸ MEN1 O00255 5/20 0.52
▸ ALDH1A1 P00352 4/20 0.52
▸ NPSR1 Q6W5P4 3/20 0.41
▸ MAPK1 P28482 2/20 0.41
▸ CYP3A4 P08684 1/20 0.41
▸ CYP2C9 P11712 1/20 0.41
▸ TSHR P16473 1/20 0.41
▸ CYP2C19 P33261 1/20 0.41
▸ ATM Q13315 2/20 0.40
▸ KDM4E B2RXH2 1/20 0.39
▸ ALOX15 P16050 1/20 0.39
▸ P2RX4 Q99571 2/20 0.35
▸ HSD17B10 Q99714 1/20 0.35
▸ POLB P06746 1/20 0.33
▸ HPGD P15428 1/20 0.32
▸ PTGDR2 Q9Y5Y4 1/20 0.32

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
SCHEMBL9365834 0.89 LMNA (0.49) LMNASMN1; SMN2KMT2AMEN1ALDH1A1
SCHEMBL6195842 0.85 LMNA (0.56) LMNASMN1; SMN2KMT2AMEN1ALDH1A1
SCHEMBL8342494 0.80 LMNA (0.75) LMNASMN1; SMN2KMT2AMEN1ALDH1A1
SCHEMBL3859175 0.79 LMNA (0.58) LMNASMN1; SMN2KMT2AMEN1ALDH1A1
SCHEMBL8342323 0.76 LMNA (0.72) LMNASMN1; SMN2KMT2AMEN1ALDH1A1
SCHEMBL9369302 0.72 LMNA (0.78) LMNASMN1; SMN2KMT2AMEN1ALDH1A1
SCHEMBL8345917 0.72 LMNA (0.78) LMNASMN1; SMN2KMT2AMEN1ALDH1A1
SCHEMBL6195822 0.72 LMNA (1.00) LMNASMN1; SMN2KMT2AMEN1ALDH1A1
SCHEMBL9365729 0.71 LMNA (0.72) LMNASMN1; SMN2KMT2AMEN1ALDH1A1
SCHEMBL9365789 0.71 KMT2A (0.72) LMNASMN1; SMN2KMT2AMEN1ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1432701-B1 HETEROCYCLIC COMPOUNDS FOR USE IN THE TREATMENT OF DISORDERS OF THE URINARY TRACT RECORDATI IRELAND LTD (IE) 2005-12-21 — — EP disclosed
EP-1432701-A1 HETEROCYCLIC COMPOUNDS FOR USE IN THE TREATMENT OF DISORDERS OF THE URINARY TRACT RECORDATI S.A. CHEMICAL and PHARMACEUTICAL COMPANY (CH) 2004-06-30 — — EP disclosed
US-20030181446-A1 Novel N-acylated heterocycles RECORDATI S.A. 2003-09-25 — — US disclosed
US-20030162777-A1 Novel N-acylated heterocycles RECORDATI S.A. 2003-08-28 — — US disclosed
WO-2003031436-A1 HETEROCYCLIC COMPOUNDS FOR USE IN THE TREATMENT OF DISORDERS OF THE URINARY TRACT RECORDATI S.A. (CH) 2003-04-17 — — 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 (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-20030162777-A1 Novel N-acylated heterocycles HTR1A, HTR1D, HTR1E LMNA 2397/4885SMN1; SMN2 199/4885KMT2A 2287/4885
US-20030181446-A1 Novel N-acylated heterocycles HTR1A, HTR1E, HTR2C LMNA 921/4885SMN1; SMN2 120/4885KMT2A 3319/4885

“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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