SCHEMBL9507781

SCHEMBL9507781

Cc1cncc(C(=O)O)c1.[NaH]

nearest known ligand 0.96

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HCAR2 Q8TDS4 6/20 0.96
ATM Q13315 1/20 0.60
ALDH1A1 P00352 5/20 0.55
KDM4E B2RXH2 3/20 0.55
MEN1 O00255 2/20 0.55
KMT2A Q03164 2/20 0.55
POLB P06746 1/20 0.55
LMNA P02545 1/20 0.55
DDO Q99489 1/20 0.55
CYP2C9 P11712 1/20 0.55
CYP2C19 P33261 1/20 0.55
TPMT P51580 1/20 0.54
HCAR1 Q9BXC0 1/20 0.47
RAF1 P04049 1/20 0.46
SMYD3 Q9H7B4 2/20 0.45
MKNK1 Q9BUB5 1/20 0.44
MKNK2 Q9HBH9 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.43
APP P05067 1/20 0.42
GAA P10253 1/20 0.42

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
SCHEMBL185789 0.98 HCAR2 (1.00) HCAR2ATMALDH1A1KDM4EMEN1
SCHEMBL29586507 0.98 HCAR2 (1.00) HCAR2ATMALDH1A1KDM4EMEN1
SCHEMBL28807541 0.98 HCAR2 (1.00) HCAR2ATMALDH1A1KDM4EMEN1
Ammonia Solution, Strong SCHEMBL27341465 0.96 HCAR2 (0.96) HCAR2ATMALDH1A1KDM4EMEN1
Hydrochloric Acid SCHEMBL1374255 0.96 HCAR2 (0.96) HCAR2ATMALDH1A1KDM4EMEN1
Methyl Alcohol SCHEMBL28625386 0.96 HCAR2 (0.96) HCAR2ATMALDH1A1KDM4EMEN1
Formaldehyde SCHEMBL27662616 0.94 HCAR2 (0.92) HCAR2ATMALDH1A1KDM4EMEN1
Hydrazine SCHEMBL28220034 0.94 HCAR2 (0.92) HCAR2ATMALDH1A1KDM4EMEN1
Methylene Chloride SCHEMBL28328829 0.90 HCAR2 (0.85) HCAR2ATMALDH1A1KDM4EMEN1
SCHEMBL51830 0.81 HCAR2 (0.70) HCAR2ALDH1A1KDM4EMEN1KMT2A

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
EP-0272903-B1 PROCESS FOR PRODUCING A POLYARYLENE SULFIDE Tosoh Corporation (JP) 1993-07-21 EP claimed
US-4794163-A HIGH MOLECULAR WEIGHT, HEAT RESISTANCE TOSOH CORPORATION (JP) 1988-12-27 US claimed
EP-0272903-A2 Process for producing a polyarylene sulfide Tosoh Corporation (JP) 1988-06-29 EP claimed
EP-0272903-B1 PROCESS FOR PRODUCING A POLYARYLENE SULFIDE Tosoh Corporation (JP) 1993-07-21 EP disclosed
US-4794163-A HIGH MOLECULAR WEIGHT, HEAT RESISTANCE TOSOH CORPORATION (JP) 1988-12-27 US disclosed
EP-0272903-A2 Process for producing a polyarylene sulfide Tosoh Corporation (JP) 1988-06-29 EP disclosed