SCHEMBL7930488

SCHEMBL7930488

CCCCCCCCOc1ccc(NC=O)cc1

nearest known ligand 0.60

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 1/20 0.58
RAB9A P51151 1/20 0.58
NR5A1 Q13285 1/20 0.54
TP53 P04637 1/20 0.53
TSHR P16473 1/20 0.53
FAAH O00519 12/20 0.52
PLA2G4B P0C869 1/20 0.51

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
SCHEMBL10563396 1.00 NPC1 (0.58) NPC1RAB9ANR5A1TP53TSHR
SCHEMBL2089958 1.00 NPC1 (0.58) NPC1RAB9ANR5A1TP53TSHR
SCHEMBL7525725 1.00 NPC1 (0.58) NPC1RAB9ANR5A1TP53TSHR
SCHEMBL19946505 1.00 NPC1 (0.58) NPC1RAB9ANR5A1TP53TSHR
SCHEMBL19946498 1.00 NPC1 (0.58) NPC1RAB9ANR5A1TP53TSHR
SCHEMBL5948127 1.00 NPC1 (0.58) NPC1RAB9ANR5A1TP53TSHR
SCHEMBL8957605 1.00 NPC1 (0.58) NPC1RAB9ANR5A1TP53TSHR
SCHEMBL2200288 1.00 NPC1 (0.58) NPC1RAB9ANR5A1TP53TSHR
SCHEMBL7929814 1.00 NPC1 (0.58) NPC1RAB9ANR5A1TP53TSHR
SCHEMBL2089558 0.98 NPC1 (0.59) NPC1RAB9ANR5A1TP53TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-107428681-B Marine periphyton repellent composition 芭赛璐化学株式会社 2020-10-27 CN disclosed
US-20190161439-A1 MARINE SESSILE ORGANISM-REPELLING COMPOSITION BASSERU CHEMICAL CO., LTD. (JP) 2019-05-30 US disclosed
EP-3309145-A1 MARINE PERIPHYTON REPELLENT COMPOSITION Basseru Chemical Co., Ltd. (JP) 2018-04-18 EP disclosed
US-20180072657-A1 MARINE SESSILE ORGANISM-REPELLING COMPOSITION BASSERU CHEMICAL CO., LTD. (JP) 2018-03-15 US disclosed
CN-107428681-A MARINE PERIPHYTON REPELLENT COMPOSITION 芭赛璐化学株式会社 2017-12-01 CN disclosed
US-20100311827-A1 Chlorogenic acid derivatives and their use as anti-fungal agents GENESIS GROUP INC. (CA) 2010-12-09 US disclosed
EP-0661350-B1 Quinizarin compound, method for production thereof, and use therefor NIPPON CATALYTIC CHEM IND (JP) 2001-08-22 EP disclosed
US-5817843-A Quinizarin compound, method for production thereof, and use therefor NIPPON SHOKUBAI CO., LTD. (JP) 1998-10-06 US disclosed
US-5608091-A SHEETS FOR HEAT EXCHANGING AND OPTICAL RECORDING MATERIAL NIPPON SHOKUBAI CO., LTD. (JP) 1997-03-04 US disclosed
EP-0661350-A1 Quinizarin compound, method for production thereof, and use therefor NIPPON SHOKUBAI CO., LTD. (JP) 1995-07-05 EP 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 (3 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-20180072657-A1 MARINE SESSILE ORGANISM-REPELLING COMPOSITION CCL11, SPTLC3, C3AR1 NPC1 729/4885RAB9A 1106/4885NR5A1 2489/4885
US-20190161439-A1 MARINE SESSILE ORGANISM-REPELLING COMPOSITION CCL11, SPTLC3, C3AR1 NPC1 729/4885RAB9A 1106/4885NR5A1 2489/4885
US-20100311827-A1 Chlorogenic acid derivatives and their use as anti-fungal agents ERG28, CYP51A1, ETF1 NPC1 308/4885RAB9A 1962/4885NR5A1 858/4885

“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.