SCHEMBL31486983

SCHEMBL31486983

O=C(O)c1c2n(c3ccc(F)cc13)CCOCC2

nearest known ligand 0.40

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 1/20 0.40
NPY5R Q15761 1/20 0.40
KDM4C Q9H3R0 2/20 0.37
ALDH1A1 P00352 1/20 0.37
PER2 O15055 2/20 0.37
CRY2 Q49AN0 1/20 0.37
CNR2 P34972 2/20 0.36
GAA P10253 2/20 0.36
SCN5A Q14524 1/20 0.36
SCN9A Q15858 1/20 0.36
MAPK1 P28482 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.35
AKR1C3 P42330 1/20 0.35
HDAC1 Q13547 1/20 0.35
HDAC6 Q9UBN7 1/20 0.35
CNR1 P21554 1/20 0.35

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
SCHEMBL31486773 0.86 HTR2A (0.47) KMT2ANPY5RPER2CRY2CNR2
SCHEMBL31487330 0.84 KMT2A (0.57) KMT2AALDH1A1PER2CRY2GAA
SCHEMBL31486817 0.84 KMT2A (0.57) KMT2AALDH1A1PER2CRY2GAA
SCHEMBL31486784 0.82 KMT2A (0.51) KMT2AALDH1A1PER2CRY2GAA
SCHEMBL31486998 0.81 HTR2A (0.48) ALDH1A1
SCHEMBL31486876 0.81 KMT2A (0.40) KMT2ANPY5RKDM4CALDH1A1PER2
SCHEMBL31486779 0.76 HTR3A (0.54) CNR2
SCHEMBL31486818 0.74 KDM5A (0.36) KMT2AKDM4CALDH1A1PER2CRY2
SCHEMBL18988864 0.72 PHGDH (0.35) KMT2AALDH1A1CNR2AKR1C3CNR1
SCHEMBL31486796 0.69 HTR2A (0.66)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2025077825-A1 METHODS AND COMPOSITIONS FOR TREATING CARDIO-PULMONARY DISORDERS FAUNA BIO INCORPORATED (US) 2025-04-17 WO disclosed