SCHEMBL21499358

SCHEMBL21499358

COc1cc2c(cc1NC(=O)c1ccc(Cl)cc1)CCCCN2

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 6/20 0.57
ALDH1A1 P00352 5/20 0.57
LMNA P02545 3/20 0.57
SMN1; SMN2 Q16637 3/20 0.57
DHODH Q02127 2/20 0.57
HPGD P15428 1/20 0.57
HTT P42858 1/20 0.57
KDM4E B2RXH2 4/20 0.57
NPSR1 Q6W5P4 1/20 0.57
CYP1A2 P05177 2/20 0.54
CYP3A4 P08684 2/20 0.54
CYP2C19 P33261 2/20 0.54
HDAC1 Q13547 1/20 0.52
HDAC8 Q9BY41 1/20 0.52
HDAC6 Q9UBN7 1/20 0.52
USP2 O75604 1/20 0.48
MAPK1 P28482 1/20 0.48
RAB9A P51151 3/20 0.47
KMT2A Q03164 2/20 0.47
TACR1 P25103 1/20 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
SCHEMBL21499312 0.90 MAPT (0.58) MAPTALDH1A1LMNASMN1; SMN2DHODH
SCHEMBL21499332 0.89 LMNA (0.58) MAPTALDH1A1LMNASMN1; SMN2DHODH
SCHEMBL21499368 0.89 ALDH1A1 (0.59) MAPTALDH1A1LMNASMN1; SMN2DHODH
SCHEMBL21499314 0.88 MAPT (0.56) MAPTALDH1A1LMNASMN1; SMN2DHODH
SCHEMBL21468548 0.88 MAPT (0.76) MAPTALDH1A1LMNASMN1; SMN2DHODH
SCHEMBL21499328 0.87 MAPT (0.61) MAPTALDH1A1LMNASMN1; SMN2DHODH
SCHEMBL21499394 0.87 MAPT (0.64) MAPTALDH1A1LMNASMN1; SMN2DHODH
SCHEMBL21499329 0.87 MAPT (0.55) MAPTALDH1A1LMNASMN1; SMN2DHODH
SCHEMBL21499319 0.87 MAPT (0.55) MAPTALDH1A1LMNASMN1; SMN2DHODH
SCHEMBL21499335 0.87 MAPT (0.47) MAPTALDH1A1LMNASMN1; SMN2DHODH

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10450263-B2 Benzo annulenes as antiviral agents SOUTHERN RESEARCH INSTITUTE (US) 2019-10-22 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-10450263-B2 Benzo annulenes as antiviral agents MAVS, ZC3HAV1, GABBR1 MAPT 760/4885ALDH1A1 187/4885LMNA 3559/4885

“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.