SCHEMBL9350740

SCHEMBL9350740

N=C(c1ccccc1)c1cc[nH]n1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
F2 P00734 2/20 0.37
F10 P00742 1/20 0.37
F12 P00748 1/20 0.37
F7 P08709 1/20 0.37
F3 P13726 1/20 0.37
PKM P14618 1/20 0.37
BLM P54132 1/20 0.35
PRSS1 P07477 1/20 0.34
PRSS2 P07478 1/20 0.34
C1S P09871 1/20 0.34
PRSS3 P35030 1/20 0.34
RECQL P46063 1/20 0.34
KMT2A Q03164 1/20 0.34
IDO1 P14902 1/20 0.31
METAP2 P50579 1/20 0.31
KEAP1 Q14145 1/20 0.31
ALOX15 P16050 1/20 0.31
LMNA P02545 1/20 0.31
CYP1A2 P05177 1/20 0.31
GAA P10253 1/20 0.30

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
SCHEMBL22616190 0.83
SCHEMBL11256292 0.79 F2 (0.33) F2PKMKMT2ALMNAGAA
SCHEMBL135361 0.76 KMT2A (0.50) F2PKMKMT2ALMNAGAA
SCHEMBL7738334 0.76 PKM (0.37) F2F10F12F7F3
SCHEMBL1177045 0.76 CES2 (0.34) F2KMT2ALMNACYP1A2GAA
SCHEMBL30081232 0.76 MEN1 (0.37) F2KMT2ALMNAGAARAB9A
SCHEMBL28785921 0.76 MAPT (0.33) F2KMT2AALOX15LMNAGAA
SCHEMBL30195047 0.73
SCHEMBL6603475 0.72 F2 (0.32) F2PKMKMT2ALMNAGAA
SCHEMBL1177064 0.71 PAM (0.36) KMT2ALMNASMN1; SMN2TSHRCES2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0293220-B1 Pharmacologically active 2-and 3-substituted (1', 5'-diaryl-3-pyrazolyl)-N-Hydroxypropanamides and method for synthesizing ORTHO PHARMA CORP (US) 1994-08-31 EP disclosed
EP-0248594-B1 Pharmacologically active 1,5-diaryl-3-substituted-pyrazoles and method for synthesizing the same ORTHO PHARMA CORP (US) 1993-11-24 EP disclosed
US-5242940-A Antiinflammatory agents ORTHO PHARMACEUTICAL CORPORATION (US) 1993-09-07 US disclosed
US-5164381-A Cardiovascular, antiinflammatory ORTHO PHARMACEUTICAL CORPORATION (US) 1992-11-17 US disclosed
US-5051518-A Antiinflammatory agents and cardiovascular disorders ORTHO PHARMACEUTICAL CORPORATION (US) 1991-09-24 US disclosed
US-4826868-A 1,5-Diaryl-3-substituted pyrazoles pharmaceutical compositions and use ORTHO PHARMACEUTICAL CORPORATION (US) 1989-05-02 US disclosed
EP-0293220-A2 Pharmacologically active 2-and 3-substituted (1', 5'-diaryl-3-pyrazolyl)-N-Hydroxypropanamides and method for synthesizing ORTHO PHARMACEUTICAL CORPORATION (US) 1988-11-30 EP disclosed
EP-0248594-A2 Pharmacologically active 1,5-diaryl-3-substituted-pyrazoles and method for synthesizing the same ORTHO PHARMACEUTICAL CORPORATION (US) 1987-12-09 EP disclosed
CN-87103953-A Pharmaceutically active 1, 5-diaryl-3-substituted pyrazoles and synthesis method thereof 1987-12-09 CN disclosed