SCHEMBL9310951

SCHEMBL9310951

OC1CCN(c2nnc(Cl)c3ccccc23)CC1

nearest known ligand 0.66

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 5/20 0.66
MEN1 O00255 3/20 0.66
GFER P55789 1/20 0.66
PKM P14618 1/20 0.56
TSHR P16473 1/20 0.56
HPGD P15428 1/20 0.49
NPSR1 Q6W5P4 3/20 0.46
HTT P42858 2/20 0.46
ALDH1A1 P00352 1/20 0.43
POLB P06746 1/20 0.43
LMNA P02545 3/20 0.43
MAPT P10636 2/20 0.43
MAPK1 P28482 2/20 0.43
SMN1; SMN2 Q16637 1/20 0.42
MAOB P27338 1/20 0.41
HTR6 P50406 1/20 0.41
PDE5A O76074 4/20 0.41
PIK3CA P42336 1/20 0.41
CDC7 O00311 1/20 0.40
PLK4 O00444 1/20 0.40

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
SCHEMBL13181182 0.84 KMT2A (0.66) KMT2AMEN1GFERPKMTSHR
SCHEMBL580682 0.82 MEN1 (0.63) KMT2AMEN1GFERPKMTSHR
SCHEMBL18296853 0.81 SMN1; SMN2 (0.68) KMT2AMEN1GFERPKMTSHR
SCHEMBL12785941 0.80 KMT2A (0.60) KMT2AMEN1GFERPKMTSHR
SCHEMBL2210096 0.80 MEN1 (1.00) KMT2AMEN1GFERPKMTSHR
Hydrochloric Acid SCHEMBL1268228 0.79 KMT2A (0.59) KMT2AMEN1GFERPKMTSHR
SCHEMBL2125396 0.79 MEN1 (0.55) KMT2AMEN1GFERPKMTSHR
SCHEMBL27829670 0.78 KMT2A (0.72) KMT2AMEN1GFERPKMTSHR
SCHEMBL11177213 0.77 MAPT (0.53) KMT2AMEN1GFERPKMTSHR
SCHEMBL21221819 0.77 MEN1 (0.56) KMT2AMEN1GFERPKMTSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20210147359-A1 COMPOUNDS AND METHODS FOR TREATING CANCER DANA-FARBER CANCER INSTITUTE, INC. (US) 2021-05-20 US disclosed
US-10934256-B2 Compounds and methods for treating cancer DANA-FARBER CANCER INSTITUTE, INC. (US) 2021-03-02 US disclosed
US-10464897-B2 Compounds and methods for treating cancer DANA-FARBER CANCER INSTITUTE, INC. (US) 2019-11-05 US disclosed
US-20180148410-A1 COMPOUNDS AND METHODS FOR TREATING CANCER DANA-FARBER CANCER INSTITUTE, INC. 2018-05-31 US disclosed
US-20180148410-A1 COMPOUNDS AND METHODS FOR TREATING CANCER DANA-FARBER CANCER INSTITUTE, INC. 2018-05-31 US disclosed
WO-2016196879-A1 COMPOUNDS AND METHODS FOR TREATING CANCER DANA-FARBER CANCER INSTITUTE, INC. (US) 2016-12-08 WO disclosed
US-5292738-A Anti-virally active pyridazinamines JANSSEN PHARMACEUTICA N.V. (BE) 1994-03-08 US disclosed
US-5157035-A Viricides JANSSEN PHARMACEUTICA N. V. (BE) 1992-10-20 US disclosed
US-5001125-A Anti-virally active pyridazinamines JANSSEN PHARMACEUTICA N.V. (BE) 1991-03-19 US disclosed
EP-0156433-B1 ANTI-VIRALLY ACTIVE PYRIDAZINAMINES JANSSEN PHARMACEUTICA N.V. (BE) 1991-02-27 EP disclosed
EP-0156433-A2 Anti-virally active pyridazinamines JANSSEN PHARMACEUTICA N.V. (BE) 1985-10-02 EP disclosed
EP-0009655-B1 6-AMINO SUBSTITUTED N-PYRROLYL-3-PYRIDAZINE AMINES, THEIR PREPARATION, AND PHARMACEUTICALLY ANTIHYPERTENSIVE COMPOSITIONS CONTAINING THEM GRUPPO LEPETIT S.P.A. (IT) 1983-05-11 EP disclosed
US-4247551-A N-Pyrrolyl-pyridazineamines and their use as antihypertensive agents GRUPPO LEPETIT S.P.A. (IT) 1981-01-27 US disclosed
EP-0009655-A1 6-Amino substituted N-pyrrolyl-3-pyridazine amines, their preparation, and pharmaceutically antihypertensive compositions containing them GRUPPO LEPETIT S.P.A. (IT) 1980-04-16 EP 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 (4 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-20180148410-A1 COMPOUNDS AND METHODS FOR TREATING CANCER GLI1, SHH, HRAS KMT2A 1177/4885MEN1 2171/4885GFER 3539/4885
US-20210147359-A1 COMPOUNDS AND METHODS FOR TREATING CANCER GLI1, SHH, SMO KMT2A 1091/4885MEN1 2194/4885GFER 3509/4885
US-10934256-B2 Compounds and methods for treating cancer GLI1, SHH, HRAS KMT2A 1177/4885MEN1 2171/4885GFER 3539/4885
US-10464897-B2 Compounds and methods for treating cancer GLI1, SHH, HRAS KMT2A 1177/4885MEN1 2171/4885GFER 3539/4885

“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.