SCHEMBL9853223

SCHEMBL9853223

CCCCCCCCCCCCCCCCCCc1ccccc1.[NaH]

nearest known ligand 0.77

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KCNH2 Q12809 1/20 0.69
▸ SIGMAR1 Q99720 6/20 0.60
▸ HTR2A P28223 2/20 0.59
▸ ESR1 P03372 2/20 0.59
▸ ADRA2A P08913 2/20 0.59
▸ ADORA3 P0DMS8 2/20 0.59
▸ TACR2 P21452 2/20 0.59
▸ SLC6A2 P23975 2/20 0.59
▸ SLC6A4 P31645 2/20 0.59
▸ SLC6A3 Q01959 2/20 0.59
▸ KDM4E B2RXH2 1/20 0.59
▸ ALDH1A1 P00352 1/20 0.59
▸ LMNA P02545 1/20 0.59
▸ SHBG P04278 1/20 0.59
▸ TP53 P04637 1/20 0.59
▸ CYP3A4 P08684 1/20 0.59
▸ HSPD1 P10809 1/20 0.59
▸ ADRB3 P13945 1/20 0.59
▸ HTR2C P28335 1/20 0.59
▸ HSPE1 P61604 1/20 0.59

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
SCHEMBL9858292 1.00 KCNH2 (0.69) KCNH2SIGMAR1HTR2AESR1ADRA2A
SCHEMBL9568691 1.00 KCNH2 (0.69) KCNH2SIGMAR1HTR2AESR1ADRA2A
SCHEMBL318925 1.00 KCNH2 (0.69) KCNH2SIGMAR1HTR2AESR1ADRA2A
SCHEMBL11704527 1.00 KCNH2 (0.69) KCNH2SIGMAR1HTR2AESR1ADRA2A
SCHEMBL11855272 1.00 KCNH2 (0.69) KCNH2SIGMAR1HTR2AESR1ADRA2A
SCHEMBL7768473 1.00 KCNH2 (0.69) KCNH2SIGMAR1HTR2AESR1ADRA2A
SCHEMBL2299713 1.00 KCNH2 (0.69) KCNH2SIGMAR1HTR2AESR1ADRA2A
Benzene SCHEMBL8879075 1.00 KCNH2 (0.69) KCNH2SIGMAR1HTR2AESR1ADRA2A
SCHEMBL9814496 1.00 KCNH2 (0.69) KCNH2SIGMAR1HTR2AESR1ADRA2A
SCHEMBL10611454 1.00 KCNH2 (0.69) KCNH2SIGMAR1HTR2AESR1ADRA2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116410543-A Nucleating agent master batch, preparation method thereof and application of nucleating agent master batch in low-melt-index polypropylene material 山东齐润源新材料科技有限公司 2023-07-11 — — CN claimed
CN-112814266-A Flame-retardant wall brick 金枝 2021-05-18 — — CN disclosed
EP-0428204-A2 Powdered abrasive cleansers with encapsulated perfume THE PROCTER & GAMBLE COMPANY (US) 1991-05-22 — — EP disclosed
US-4961871-A Powdered abrasive cleansers with encapsulated perfume THE PROCTER & GAMBLE COMPANY (US) 1990-10-09 — — US disclosed
EP-0179574-B1 BENZYL ALCOHOL FOR IMPROVED POWDERED CLEANSERS THE PROCTER & GAMBLE COMPANY (US) 1989-01-25 — — EP disclosed
US-4740423-A INORGANIC POWDERS IN OLEOPHILIC DISPERSANT, GRINDING SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1988-04-26 — — US disclosed
US-4615821-A ABRASIVE CLEANSER THE PROCTER & GAMBLE COMPANY (US) 1986-10-07 — — US disclosed
EP-0179574-A1 Benzyl alcohol for improved powdered cleansers THE PROCTER & GAMBLE COMPANY (US) 1986-04-30 — — EP disclosed
US-4584243-A Abrasive, production thereof and use thereof in magnetic recording medium SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1986-04-22 — — US disclosed
US-4287080-A Detergent compositions which contain certain tertiary alcohols THE PROCTER & GAMBLE COMPANY (US) 1981-09-01 — — US disclosed
US-3996149-A SILICA BURKE OLIVER W JUN 1976-12-07 — — US disclosed
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