SCHEMBL234785

SCHEMBL234785

Nc1cc(C2CCC2)n[nH]1

nearest known ligand 0.44

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 1/20 0.44
HRH4 Q9H3N8 10/20 0.42
HCAR2 Q8TDS4 1/20 0.37
HRH3 Q9Y5N1 1/20 0.35
DRD2 P14416 3/20 0.35
DRD4 P21917 3/20 0.35
DRD3 P35462 3/20 0.35
NPC1 O15118 1/20 0.34
LMNA P02545 1/20 0.34
TP53 P04637 1/20 0.34
PKM P14618 1/20 0.34
RAB9A P51151 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
PDE8B O95263 1/20 0.33
HSP90AB1 P08238 1/20 0.31

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
SCHEMBL1593290 0.96 KMT2A (0.47) KMT2AHRH4HCAR2HRH3DRD2
Ammonia Solution, Strong SCHEMBL3939167 0.94 KMT2A (0.46) KMT2AHRH4HCAR2HRH3DRD2
SCHEMBL16803471 0.94 KMT2A (0.50) KMT2AHRH4HRH3DRD2DRD4
SCHEMBL8015569 0.94 KMT2A (0.50) KMT2AHRH4HRH3DRD2DRD4
SCHEMBL170833 0.91
SCHEMBL16664269 0.84 HRH4 (0.51) KMT2AHRH4HRH3
SCHEMBL25261249 0.82 KMT2A (0.34) KMT2AHRH4HCAR2DRD2DRD4
Hydrochloric Acid SCHEMBL16648497 0.82 HRH4 (0.50) KMT2AHRH4HRH3NPC1RAB9A
SCHEMBL25261248 0.82 KMT2A (0.34) KMT2AHRH4HCAR2DRD2DRD4
SCHEMBL1988296 0.82 KDM5B (0.37) KMT2AHRH4DRD2DRD4DRD3

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 62 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11236096-B2 Fused pyrimidine compound or salt thereof TAIHO PHARMACEUTICAL CO., LTD. (JP) 2022-02-01 US disclosed
EP-3260454-B1 CONDENSED PYRIMIDINE COMPOUND OR SALT THEREOF TAIHO PHARMACEUTICAL CO LTD (JP) 2021-06-09 EP disclosed
US-11014930-B2 Fused pyrimidine compound or salt thereof TAIHO PHARMACEUTICAL CO., LTD. (JP) 2021-05-25 US disclosed
US-10981920-B2 2021-04-20 US disclosed
US-10787457-B2 Fused pyrimidine compound or salt thereof TAIHO PHARMACEUTICAL CO., LTD. (JP) 2020-09-29 US disclosed
US-20200270261-A1 FUSED PYRIMIDINE COMPOUND OR SALT THEREOF TAIHO PHARMACEUTICAL CO., LTD. (JP) 2020-08-27 US disclosed
US-20200270260-A1 FUSED PYRIMIDINE COMPOUND OR SALT THEREOF TAIHO PHARMACEUTICAL CO., LTD. (JP) 2020-08-27 US disclosed
US-10752624-B2 Kinase inhibitors ORIGENIS GMBH (DE) 2020-08-25 US disclosed
US-20190092776-A1 FUSED PYRIMIDINE COMPOUND OR SALT THEREOF TAIHO PHARMACEUTICAL CO., LTD. (JP) 2019-03-28 US disclosed
US-10233189-B2 Fused pyrimidine compound or salt thereof TAIHO PHARMACEUTICAL CO., LTD. (JP) 2019-03-19 US disclosed
EP-2265610-A1 PYRAZOLE [3, 4-B]PYRIDINE RAF INHIBITORS Array Biopharma, Inc. (US) 2010-12-29 EP disclosed
WO-2009111279-A1 PYRAZOLE [3, 4-B] PYRIDINE RAF INHIBITORS ARRAY BIOPHARMA INC. (US) 2009-09-11 WO disclosed
US-7531539-B2 Pyrrolotriazine kinase inhibitors BRISTOL-MYERS SQUIBB COMPANY (US) 2009-05-12 US disclosed
US-20080045496-A1 PYRROLOTRIAZINE KINASE INHIBITORS BRISTOL-MYERS SQUIBB COMPANY 2008-02-21 US disclosed
US-7034049-B1 3(5)-amino-pyrazole derivatives, process for their preparation and their use as antitumor agents PHARMACIA ITALIA S.P.A. (IT) 2006-04-25 US disclosed
EP-1202733-B1 3(5)-AMINO-PYRAZOLE DERIVATIVES, PROCESS FOR THEIR PREPARATION AND THEIR USE AS ANTITUMOR AGENTS PHARMACIA ITALIA SPA (IT) 2005-10-05 EP disclosed
EP-1202733-A4 3(5)-AMINO-PYRAZOLE DERIVATIVES, PROCESS FOR THEIR PREPARATION AND THEIR USE AS ANTITUMOR AGENTS PHARMACIA ITALIA SPA (IT) 2003-05-14 EP disclosed
CN-1373662-A 3(5)-amino-pyrazole derivs., process for their preparation and their use as antitumor agents PHARMACIA & UP JOHN S P A (IT) 2002-10-09 CN disclosed
EP-1202733-A1 3(5)-AMINO-PYRAZOLE DERIVATIVES, PROCESS FOR THEIR PREPARATION AND THEIR USE AS ANTITUMOR AGENTS Pharmacia Italia S.p.A. (IT) 2002-05-08 EP disclosed
WO-2001012189-A1 3(5)-AMINO-PYRAZOLE DERIVATIVES, PROCESS FOR THEIR PREPARATION AND THEIR USE AS ANTITUMOR AGENTS PHARMACIA ITALIA S.P.A. (IT) 2001-02-22 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 (10 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-11236096-B2 Fused pyrimidine compound or salt thereof RET, RB1, MECP2 KMT2A 641/4885HRH4 1567/4885HCAR2 3209/4885
US-10233189-B2 Fused pyrimidine compound or salt thereof RET, RB1, MECP2 KMT2A 641/4885HRH4 1567/4885HCAR2 3209/4885
US-10787457-B2 Fused pyrimidine compound or salt thereof RET, RB1, MECP2 KMT2A 641/4885HRH4 1567/4885HCAR2 3209/4885
US-11014930-B2 Fused pyrimidine compound or salt thereof RET, RB1, MECP2 KMT2A 641/4885HRH4 1567/4885HCAR2 3209/4885
US-20200270260-A1 FUSED PYRIMIDINE COMPOUND OR SALT THEREOF RET, RB1, MECP2 KMT2A 641/4885HRH4 1567/4885HCAR2 3209/4885
US-10981920-B2 RET, GFRA1, GFRA2 KMT2A 600/4885HRH4 2257/4885HCAR2 3082/4885
US-20200270261-A1 FUSED PYRIMIDINE COMPOUND OR SALT THEREOF RET, RB1, MECP2 KMT2A 641/4885HRH4 1567/4885HCAR2 3209/4885
US-20190092776-A1 FUSED PYRIMIDINE COMPOUND OR SALT THEREOF RET, RB1, MECP2 KMT2A 641/4885HRH4 1567/4885HCAR2 3209/4885
US-10752624-B2 Kinase inhibitors LRRK2, MYLK2, MYLK KMT2A 929/4885HRH4 1135/4885HCAR2 3902/4885
US-20080045496-A1 PYRROLOTRIAZINE KINASE INHIBITORS JAK2, NTRK2, NTRK3 KMT2A 1500/4885HRH4 2522/4885HCAR2 1791/4885

“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.