SCHEMBL18762013

SCHEMBL18762013

CCOc1cc2ccccc2o1

nearest known ligand 0.47

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
POLB P06746 2/20 0.47
HTR1A P08908 3/20 0.46
DRD2 P14416 3/20 0.46
HTR2B P41595 3/20 0.46
AGXT P21549 1/20 0.44
LOXL2 Q9Y4K0 1/20 0.44
F2RL3 Q96RI0 1/20 0.44
NPC1 O15118 1/20 0.44
RAB9A P51151 1/20 0.44
MAOB P27338 1/20 0.43
GAA P10253 1/20 0.42
KDM4E B2RXH2 2/20 0.41
ALDH1A1 P00352 1/20 0.41
LMNA P02545 1/20 0.41
CYP2A6 P11509 2/20 0.40
FLT3 P36888 1/20 0.40
MGLL Q99685 1/20 0.40
HSD17B10 Q99714 1/20 0.40
TDP1 Q9NUW8 1/20 0.40

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
SCHEMBL28087517 0.85 CA12 (0.42) POLBHTR1ADRD2HTR2BNPC1
SCHEMBL3541730 0.85 ALDH1A1 (0.49) POLBHTR1ADRD2HTR2BAGXT
SCHEMBL29424653 0.83 KDM4E (0.41) POLBHTR1ADRD2HTR2BAGXT
SCHEMBL28167314 0.83 AGXT (0.43) POLBHTR1ADRD2HTR2BAGXT
SCHEMBL16534423 0.82 FAAH (0.44) HTR1AHTR2BAGXTLOXL2MAOB
SCHEMBL5719086 0.81 AGXT (0.44) POLBAGXTLOXL2NPC1RAB9A
SCHEMBL28720245 0.80 ALDH1A1 (0.43) POLBAGXTLOXL2NPC1RAB9A
SCHEMBL28712168 0.79 ALDH1A1 (0.42) AGXTLOXL2NPC1RAB9AGAA
SCHEMBL10878681 0.78 AGXT (0.42) POLBHTR1AHTR2BAGXTLOXL2
SCHEMBL4678729 0.78 LOXL2 (0.50) POLBAGXTLOXL2MAOBKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3383354-A1 DELIVERY SYSTEM FOR ACTIVE AGENTS Symrise AG (DE) 2018-10-10 EP disclosed
US-9974721-B2 Cosmetic composition for lightening skin and hair SYMRISE AG (DE) 2018-05-22 US disclosed
WO-2017092818-A1 DELIVERY SYSTEM FOR ACTIVE AGENTS SYMRISE AG (DE) 2017-06-08 WO disclosed
US-20170112736-A1 Cosmetic Composition for Lightening Skin and Hair SYMRISE AG (DE) 2017-04-27 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20170112736-A1 Cosmetic Composition for Lightening Skin and Hair TYR, LARP1, LPO POLB 150/4885HTR1A 1493/4885DRD2 2831/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.