SCHEMBL14848723

SCHEMBL14848723

CCCCCCCCOc1cccc(C)c1C(C)(C)C

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MCHR1 Q99705 2/20 0.44
▸ LMNA P02545 2/20 0.44
▸ MEN1 O00255 1/20 0.44
▸ NR1I2 O75469 1/20 0.44
▸ CHRM2 P08172 1/20 0.44
▸ CYP3A4 P08684 1/20 0.44
▸ ADRA2A P08913 1/20 0.44
▸ MAPT P10636 1/20 0.44
▸ OPRK1 P41145 1/20 0.44
▸ HTR2B P41595 1/20 0.44
▸ SLC6A3 Q01959 1/20 0.44
▸ KMT2A Q03164 1/20 0.44
▸ HDAC6 Q9UBN7 1/20 0.44
▸ ESR1 P03372 2/20 0.42
▸ CYP1A2 P05177 1/20 0.41
▸ CYP2C9 P11712 1/20 0.41
▸ CYP2C19 P33261 1/20 0.41
▸ TSHR P16473 2/20 0.41
▸ ALDH1A1 P00352 3/20 0.40
▸ TLR8 Q9NR97 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
SCHEMBL27418192 0.88 HTR1B (0.41) MCHR1LMNAMEN1CHRM2MAPT
SCHEMBL7120445 0.83 LMNA (0.47) MCHR1LMNAMEN1NR1I2CHRM2
SCHEMBL6346056 0.83 LMNA (0.47) MCHR1LMNAMEN1NR1I2CHRM2
SCHEMBL22043309 0.81 ALDH1A1 (0.42) LMNAMEN1MAPTHTR2BKMT2A
SCHEMBL21719132 0.80 HTR1B (0.40) MAPTCYP2C19TSHRALDH1A1HTR1B
SCHEMBL2711055 0.80 HTR1B (0.59) MCHR1LMNAMEN1NR1I2CHRM2
SCHEMBL22207443 0.79 ALDH1A1 (0.58) MCHR1LMNAMEN1NR1I2CHRM2
SCHEMBL22207086 0.79 ALDH1A1 (0.58) MCHR1LMNAMEN1NR1I2CHRM2
SCHEMBL22207345 0.79 ALDH1A1 (0.58) MCHR1LMNAMEN1NR1I2CHRM2
SCHEMBL22207166 0.79 ALDH1A1 (0.58) MCHR1LMNAMEN1NR1I2CHRM2

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
US-20130090469-A1 GREEN ZINC PORPHYRIN SENSITIZERS AND THEIR APPLICATIONS NATIONAL CHUNG HSING UNIVERSITY (TW) 2013-04-11 — — US disclosed
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