SCHEMBL30169461

SCHEMBL30169461

O=c1c2ccccc2ccn1C1CCNCC1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTR6 P50406 4/20 0.43
PRKCG P05129 1/20 0.41
PRKCB P05771 1/20 0.41
PRKCA P17252 1/20 0.41
PRKCH P24723 1/20 0.41
PRKCE Q02156 1/20 0.41
PRKCZ Q05513 1/20 0.41
PRKCD Q05655 1/20 0.41
CAMK2B Q13554 1/20 0.41
CAMK2G Q13555 1/20 0.41
CAMK2D Q13557 1/20 0.41
CAMK2A Q9UQM7 1/20 0.41
P2RX7 Q99572 1/20 0.41
GABRA1 P14867 1/20 0.39
GABRG2 P18507 1/20 0.39
GABRB3 P28472 1/20 0.39
HTR3E A5X5Y0 1/20 0.38
HTR3B O95264 1/20 0.38
CYP1A2 P05177 1/20 0.38
HTR1A P08908 1/20 0.38

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
SCHEMBL19869853 0.89 DHODH (0.44) HSD17B10KDM4EALDH1A1HPGDGRM4
SCHEMBL7237013 0.84 GAA (0.46) TSHRHSD17B10KDM4EALDH1A1GRM4
SCHEMBL14912155 0.81 DHODH (0.40) MTORKDM4EACHEDHODHKDM4C
SCHEMBL30169524 0.80 SLC6A4 (0.46) HTR6PRKCGPRKCBPRKCAPRKCH
SCHEMBL30588460 0.77 DRD2 (0.55) HTR6PRKCGPRKCBPRKCAPRKCH
SCHEMBL1239171 0.77 DRD2 (0.55) HTR6PRKCGPRKCBPRKCAPRKCH
SCHEMBL30169395 0.77 LMNA (0.40) HTR6P2RX7HTR1ALMNAKDM4C
SCHEMBL7436441 0.76 HTR3A (0.50) HTR3EHTR3BHTR3AHTR3DHTR3C
SCHEMBL8890709 0.76 ALDH1A1 (0.41) HTR6PRKCGPRKCBPRKCAPRKCH
Hydrochloric Acid SCHEMBL1239782 0.76 DRD2 (0.54) HTR6PRKCGPRKCBPRKCAPRKCH

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118239959-A Cyclopropane TLR7 and 8 inhibitor and preparation method and application thereof 上海深势唯思科技有限责任公司 2024-06-25 CN disclosed
CN-115551593-A Compounds and methods for modulating splicing 雷密克斯医疗公司 2022-12-30 CN disclosed