SCHEMBL16697303

SCHEMBL16697303

O=C(Nc1cc(F)ccc1N1CCN(c2ccccc2)CC1)c1ccncc1

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 6/20 0.64
NPSR1 Q6W5P4 3/20 0.64
TSHR P16473 3/20 0.64
SMN1; SMN2 Q16637 3/20 0.64
ALDH1A1 P00352 3/20 0.64
HPGD P15428 2/20 0.64
USP2 O75604 1/20 0.64
HSD17B10 Q99714 1/20 0.64
LMNA P02545 2/20 0.64
KDM4E B2RXH2 1/20 0.64
PLA2G1B P04054 1/20 0.60
ATG4B Q9Y4P1 1/20 0.60
TP53 P04637 2/20 0.57
GAA P10253 1/20 0.57
SRPK1 Q96SB4 2/20 0.56
KDR P35968 1/20 0.56
SRPK2 P78362 1/20 0.56
SRPK3 Q9UPE1 1/20 0.56
CDK4 P11802 1/20 0.56
CDK9 P50750 1/20 0.56

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
SCHEMBL16697768 0.86 CDK4 (0.75) MAPTNPSR1TSHRSMN1; SMN2ALDH1A1
SCHEMBL31187476 0.86 SRPK1 (0.74) MAPTNPSR1TSHRSMN1; SMN2ALDH1A1
SCHEMBL22700680 0.86 SRPK1 (0.74) MAPTNPSR1TSHRSMN1; SMN2ALDH1A1
SCHEMBL3485720 0.86 SRPK1 (0.74) MAPTNPSR1TSHRSMN1; SMN2ALDH1A1
SCHEMBL23196345 0.85 MAPT (0.52) MAPTNPSR1TSHRSMN1; SMN2ALDH1A1
SCHEMBL20198520 0.81 NPSR1 (0.72) MAPTNPSR1TSHRSMN1; SMN2ALDH1A1
SCHEMBL23196454 0.79 SRPK1 (0.53) MAPTALDH1A1HPGDSRPK1KDR
SCHEMBL3485920 0.73 SRPK1 (0.98) MAPTNPSR1TSHRALDH1A1HPGD
SCHEMBL22700670 0.73 KMT2A (0.71) MAPTNPSR1TSHRSMN1; SMN2ALDH1A1
SCHEMBL3485343 0.73 KMT2A (0.71) MAPTNPSR1TSHRSMN1; SMN2ALDH1A1

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
US-20210100781-A1 TUMOR SUPPRESSION KYOTO UNIVERSITY (JP) 2021-04-08 US disclosed
WO-2020235672-A1 PHARMACEUTICAL COMPOSITION FOR ALZHEIMER'S DISEASE 国立大学法人京都大学 (JP) 2020-11-26 WO disclosed
US-20150133467-A1 SCREENING METHOD, PROTEIN INSTABILITY AND/OR STABILITY INDUCERS, AND PROTEIN ACTIVITY ASSESSMENT KYOTO UNIVERSITY (JP) 2015-05-14 US disclosed
US-20150133467-A1 SCREENING METHOD, PROTEIN INSTABILITY AND/OR STABILITY INDUCERS, AND PROTEIN ACTIVITY ASSESSMENT KYOTO UNIVERSITY (JP) 2015-05-14 US disclosed
US-20150133467-A1 SCREENING METHOD, PROTEIN INSTABILITY AND/OR STABILITY INDUCERS, AND PROTEIN ACTIVITY ASSESSMENT KYOTO UNIVERSITY (JP) 2015-05-14 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-20150133467-A1 SCREENING METHOD, PROTEIN INSTABILITY AND/OR STABILITY INDUCERS, AND PROTEIN ACTIVITY ASSESSMENT IGF2BP1, IGF2BP2, IGF2BP3 MAPT 3384/4885NPSR1 3633/4885TSHR 3338/4885
US-20210100781-A1 TUMOR SUPPRESSION TSG101, TP53, VHL MAPT 4590/4885NPSR1 1962/4885TSHR 2819/4885

“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.