SCHEMBL22339753

SCHEMBL22339753

CCOc1cccc(OCCN(C)C)c1C(=O)Nc1ccc(Cl)cc1

nearest known ligand 0.56

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 1/20 0.56
SMN1; SMN2 Q16637 2/20 0.53
MEN1 O00255 4/20 0.52
KMT2A Q03164 4/20 0.52
ALDH1A1 P00352 3/20 0.52
NPC1 O15118 2/20 0.52
LMNA P02545 2/20 0.52
KDR P35968 3/20 0.48
TSHR P16473 2/20 0.47
PTPN1 P18031 1/20 0.46
MCHR1 Q99705 1/20 0.43
KDM4E B2RXH2 3/20 0.43
GAA P10253 1/20 0.43
MAPT P10636 1/20 0.43
RAB9A P51151 1/20 0.43
TAS1R3 Q7RTX0 1/20 0.43
TAS1R1 Q7RTX1 1/20 0.43

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
SCHEMBL14949997 0.89 SMN1; SMN2 (0.53) SMN1; SMN2MEN1KMT2AALDH1A1NPC1
SCHEMBL22339755 0.87 NPC1 (0.54) HRH3SMN1; SMN2MEN1KMT2AALDH1A1
SCHEMBL10067677 0.86 RXFP1 (0.54) SMN1; SMN2KMT2ALMNATSHRPTPN1
SCHEMBL14239759 0.86 KDR (0.51) SMN1; SMN2ALDH1A1NPC1LMNAKDR
SCHEMBL22341765 0.84 PTPN1 (0.44) HRH3SMN1; SMN2ALDH1A1NPC1KDR
SCHEMBL18804907 0.83 KCNK3 (0.54) SMN1; SMN2MEN1KMT2AALDH1A1NPC1
SCHEMBL22339741 0.82 KDR (0.50) SMN1; SMN2NPC1LMNAKDRMCHR1
SCHEMBL9951429 0.82 RXFP1 (0.49) SMN1; SMN2MEN1KMT2AALDH1A1LMNA
SCHEMBL31376514 0.82 RXFP1 (0.49) SMN1; SMN2MEN1KMT2AALDH1A1LMNA
SCHEMBL29677914 0.82 RXFP1 (0.49) SMN1; SMN2MEN1KMT2AALDH1A1LMNA

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-20220127232-A1 HISTONE ACETYLTRANSFERASE MODULATORS AND COMPOSITIONS AND USES THEREOF APPIA PHARMACEUTICALS LLC 2022-04-28 US disclosed
WO-2020163731-A1 HISTONE ACETYLTRANSFERASE MODULATORS AND COMPOSITIONS AND USES THEREOF THE TRUSTEES OF COLUMBIA UNIVERSITY IN THE CITY OF NEW YORK (US) 2020-08-13 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-20220127232-A1 HISTONE ACETYLTRANSFERASE MODULATORS AND COMPOSITIONS AND USES THEREOF EP300, KAT2A, NAA40 HRH3 455/4885SMN1; SMN2 769/4885MEN1 2627/4885

“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.