SCHEMBL20108800

SCHEMBL20108800

OCCN1CCN(c2nnc(-c3ccccc3)c3ccccc23)CC1

nearest known ligand 0.81

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 5/20 0.81
KMT2A Q03164 5/20 0.81
KDR P35968 7/20 0.65
ALDH1A1 P00352 4/20 0.62
HTT P42858 3/20 0.62
KDM4E B2RXH2 1/20 0.62
SMO Q99835 2/20 0.60
LMNA P02545 2/20 0.58
USP2 O75604 1/20 0.58
POLB P06746 1/20 0.58
NPSR1 Q6W5P4 2/20 0.58
MAPT P10636 1/20 0.58
SMN1; SMN2 Q16637 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
SCHEMBL20108806 0.76 KMT2A (0.70) MEN1KMT2AKDRALDH1A1SMO
SCHEMBL20109603 0.76 KMT2A (0.71) MEN1KMT2AALDH1A1HTTSMO
SCHEMBL2278171 0.75 ALDH1A1 (0.68) MEN1KMT2AKDRALDH1A1HTT
SCHEMBL10814181 0.75 MEN1 (0.60) MEN1KMT2AALDH1A1HTTKDM4E
Hydrochloric Acid SCHEMBL11179714 0.75 LMNA (0.69) MEN1KMT2AALDH1A1HTTKDM4E
SCHEMBL1752971 0.75 MEN1 (0.55) MEN1KMT2AALDH1A1HTTKDM4E
SCHEMBL20109369 0.75 KDR (0.78) KMT2AKDRALDH1A1SMOSMN1; SMN2
SCHEMBL20109351 0.74 KMT2A (0.70) MEN1KMT2AKDRALDH1A1HTT
SCHEMBL21239006 0.74 KMT2A (0.70) MEN1KMT2AKDRALDH1A1HTT
SCHEMBL13977440 0.73 NPSR1 (1.00) MEN1KMT2AKDRALDH1A1HTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20190241574-A1 PHENYL PHTHALAZINE DERIVATIVE, METHOD FOR THE PREPARATION THEREOF, AND PHARMACEUTICAL COMPOSITION COMPRISING THE SAME SEOUL NATIONAL UNIVERSITY HOSPITAL (KR) 2019-08-08 US claimed
US-10947241-B2 Phenyl phthalazine derivative, method for the preparation thereof, and pharmaceutical composition comprising the same SEOUL NATIONAL UNIVERSITY HOSPITAL (KR) 2021-03-16 US disclosed
US-10947241-B2 Phenyl phthalazine derivative, method for the preparation thereof, and pharmaceutical composition comprising the same SEOUL NATIONAL UNIVERSITY HOSPITAL (KR) 2021-03-16 US disclosed
US-20190241574-A1 PHENYL PHTHALAZINE DERIVATIVE, METHOD FOR THE PREPARATION THEREOF, AND PHARMACEUTICAL COMPOSITION COMPRISING THE SAME SEOUL NATIONAL UNIVERSITY HOSPITAL (KR) 2019-08-08 US disclosed
US-20190241574-A1 PHENYL PHTHALAZINE DERIVATIVE, METHOD FOR THE PREPARATION THEREOF, AND PHARMACEUTICAL COMPOSITION COMPRISING THE SAME SEOUL NATIONAL UNIVERSITY HOSPITAL (KR) 2019-08-08 US disclosed
WO-2018080216-A1 PHENYL PHTHALAZINE DERIVATIVE, METHOD FOR THE PREPARATION THEREOF, AND PHARMACEUTICAL COMPOSITION COMPRISING THE SAME DAEWOONG PHARMACEUTICAL CO., LTD. (KR) 2018-05-03 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-20190241574-A1 PHENYL PHTHALAZINE DERIVATIVE, METHOD FOR THE PREPARATION THEREOF, AND PHARMACEUTICAL COMPOSITION COMPRISING THE SAME PAH, HDAC5, SLC5A1 MEN1 1004/4885KMT2A 804/4885KDR 1710/4885
US-10947241-B2 Phenyl phthalazine derivative, method for the preparation thereof, and pharmaceutical composition comprising the same PAH, HDAC5, SLC5A1 MEN1 1004/4885KMT2A 804/4885KDR 1710/4885

“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.