SCHEMBL24988936

SCHEMBL24988936

Cc1cc(N)c2[nH]cc(C)c2c1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.39
MAPT P10636 2/20 0.39
KDM4E B2RXH2 2/20 0.39
GAA P10253 2/20 0.39
LMNA P02545 1/20 0.39
TDP1 Q9NUW8 2/20 0.37
REN P00797 3/20 0.36
CYP3A4 P08684 3/20 0.36
TSHR P16473 2/20 0.36
MAPK1 P28482 1/20 0.36
PKM P14618 1/20 0.34
ALOX15 P16050 2/20 0.33
CYP1A2 P05177 1/20 0.33
CYP2C19 P33261 1/20 0.33
TP53 P04637 1/20 0.33
THRB P10828 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
ATM Q13315 1/20 0.33
AR P10275 1/20 0.33
CD44 P16070 1/20 0.32

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
SCHEMBL20688241 0.80 MAPT (0.50) MAPTRENCYP3A4CYP1A2CYP2C19
SCHEMBL2771976 0.80 CYP3A4 (0.33) ALDH1A1MAPTKDM4EGAALMNA
SCHEMBL15389028 0.80 REN (0.49) ALDH1A1LMNARENCYP3A4TSHR
SCHEMBL27174881 0.76 DYRK1A (0.41)
SCHEMBL30689179 0.75 MAPT (0.45) ALDH1A1MAPTRENCYP3A4CYP1A2
SCHEMBL16727201 0.75 GPR84 (0.40) ALDH1A1MAPTLMNARENCYP3A4
SCHEMBL24988676 0.72 SKP2 (0.46) RENCYP3A4TSHRMAPK1TP53
SCHEMBL20674527 0.72 ALDH1A1 (0.48) ALDH1A1MAPTKDM4ELMNACYP3A4
SCHEMBL7089054 0.71 REN (0.50) ALDH1A1MAPTKDM4ETDP1REN
SCHEMBL22773010 0.69 ALDH1A1 (0.50) ALDH1A1MAPTKDM4EGAALMNA

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-2023013994-A1 NOVEL INDOLE DERIVATIVE, PHARMACEUTICAL COMPOSITION COMPRISING SAME, AND USE THEREOF 주식회사 미토이뮨테라퓨틱스 2023-02-09 WO disclosed