SCHEMBL206905

SCHEMBL206905

c1ccc(C2CC[N]CC2)cc1

nearest known ligand 0.54

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
SLC18A3 Q16572 4/20 0.54
SIGMAR1 Q99720 2/20 0.54
GRIN2B Q13224 3/20 0.42
DRD2 P14416 1/20 0.42
GAA P10253 1/20 0.41
MAPT P10636 1/20 0.41
CYP2D6 P10635 3/20 0.41
CYP2C19 P33261 1/20 0.41
DHFR P00374 1/20 0.41
AKR1C3 P42330 1/20 0.41
AKR1C1 Q04828 1/20 0.41
CYP1A2 P05177 1/20 0.40
CYP2C9 P11712 1/20 0.40
TSHR P16473 1/20 0.40
HPGD P15428 1/20 0.40
KMT2A Q03164 1/20 0.40
SMN1; SMN2 Q16637 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
SCHEMBL5655487 0.91 SLC18A3 (0.47) SLC18A3SIGMAR1CYP2D6CYP2C19CYP1A2
SCHEMBL1366490 0.91 SLC18A3 (0.47) SLC18A3SIGMAR1CYP2D6CYP2C19CYP1A2
SCHEMBL242194 0.86 SLC18A3 (0.45) SLC18A3SIGMAR1GRIN2BDRD2GAA
SCHEMBL1366116 0.86 SLC18A3 (0.45) SLC18A3SIGMAR1GRIN2BDRD2GAA
SCHEMBL1367144 0.86 SLC18A3 (0.45) SLC18A3SIGMAR1GRIN2BDRD2GAA
SCHEMBL1364725 0.82 NOTUM (0.42) SLC18A3SIGMAR1DRD2DHFR
SCHEMBL41763 0.81
SCHEMBL190417 0.81 SLC18A3 (0.67) SLC18A3SIGMAR1GRIN2BDRD2GAA
SCHEMBL4176060 0.80 SLC18A3 (0.69) SLC18A3SIGMAR1GRIN2BCYP2D6CYP2C19
Benzene SCHEMBL23070411 0.78 SLC18A3 (0.64) SLC18A3SIGMAR1GRIN2BDRD2GAA

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 1028 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240197888-A1 SOS1 PROTEIN DEGRADERS, PHARMACEUTICAL COMPOSITIONS THEREOF, AND THEIR THERAPEUTIC APPLICATIONS BIOTHERYX, INC. 2024-06-20 US claimed
US-20240190885-A1 KRAS PROTEIN DEGRADERS, PHARMACEUTICAL COMPOSITIONS THEREOF, AND THEIR THERAPEUTIC APPLICATIONS BIOTHERYX INC (US) 2024-06-13 US claimed
CN-117946031-A Substituted aromatic phenol derivatives of KNa1.1 channel inhibitors 北京大学 2024-04-30 CN claimed
WO-2023001268-A1 CHRYSIN DERIVATIVE, AND PREPARATION METHOD THEREFOR AND USE THEREOF 深圳枫语生物医药科技有限公司 2023-01-26 WO claimed
CN-113773293-A Chrysin derivative and preparation method thereof 深圳枫语生物医药科技有限公司 2021-12-10 CN claimed
CN-113768915-A Application of chrysin derivative in preparation of medicine 深圳枫语生物医药科技有限公司 2021-12-10 CN claimed
CN-108586335-B 2-hydroxybenzamide-1, 2,3, 4-tetrahydroisoquinoline-O-carbamate compound and preparation method thereof 南阳师范学院 2020-07-03 CN claimed
US-10035795-B1 Phenothiazine derivatives having CaM inhibitory activity KOREA INSTITUTE OF SCIENCE AND TECHNOLOGY (KR) 2018-07-31 US claimed
US-20170174710-A1 COMPOUNDS THAT ARE S1P MODULATING AGENTS AND/OR ATX MODULATING AGENTS BIOGEN MA INC. 2017-06-22 US claimed
US-20160244408-A1 CARBAZOLE DERIVATIVES ACTING ON 5-HT7 RECEPTOR KOREA INSTITUTE OF SCIENCE AND TECHNOLOGY (KR) 2016-08-25 US claimed
EP-0023569-B1 DERIVATIVES OF CARBOXYLIC ACIDS, THEIR PREPARATION AND MEDICAMENTS CONTAINING THEM Dr. Karl Thomae GmbH (DE) 1983-06-22 EP claimed
EP-0051278-A1 Soft tertiary amine esters of bio-affecting carboxylic acids, processes for preparing and a pharmaceutical composition containing the same MERCK & CO. INC. (US) 1982-05-12 EP claimed
EP-0039051-A2 Mannich-base hydroxamic acid prodrugs for the improved bioavailability of non-steroidal anti-inflammatory agents, a process for preparing and a pharmaceutical composition containing them MERCK & CO. INC. (US) 1981-11-04 EP claimed
EP-0023569-A1 Derivatives of carboxylic acids, their preparation and medicaments containing them Dr. Karl Thomae GmbH (DE) 1981-02-11 EP claimed
EP-0020303-A1 Guanidines, process for their preparation, pharmaceutical preparations containing such compounds and their application CIBA-GEIGY AG (CH) 1980-12-10 EP claimed
EP-0020304-A1 Guanidines, process for their preparation, pharmaceutical preparations containing such compounds and their application CIBA-GEIGY AG (CH) 1980-12-10 EP claimed
US-4139626-A FUNGICIDES SYNTEX (U.S.A.) INC. (US) 1979-02-13 US claimed
US-4110536-A ANTIARRHYTHMIA MILES LABORATORIES, INC. (US) 1978-08-29 US claimed
US-4006232-A Therapeutic method of treating cardiac arrhythmias utilizing 3-substituted diphenylhydantoins MILES LABORATORIES, INC. (US) 1977-02-01 US claimed
US-3983107-A ARTERIOSCLEROSIS PFIZER INC. (US) 1976-09-28 US claimed

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

For each of this compound's patents that has machine-readable text (5 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-20240190885-A1 KRAS PROTEIN DEGRADERS, PHARMACEUTICAL COMPOSITIONS THEREOF, AND THEIR THERAPEUTIC APPLICATIONS KRAS, NRAS, APC SLC18A3 4880/4885SIGMAR1 4375/4885GRIN2B 4617/4885
US-20240197888-A1 SOS1 PROTEIN DEGRADERS, PHARMACEUTICAL COMPOSITIONS THEREOF, AND THEIR THERAPEUTIC APPLICATIONS SOS1, SOS2, SOST SLC18A3 4665/4885SIGMAR1 1547/4885GRIN2B 4618/4885
US-10035795-B1 Phenothiazine derivatives having CaM inhibitory activity CALM1, CAMK4, CAMK1 SLC18A3 2455/4885SIGMAR1 2571/4885GRIN2B 3395/4885
US-20170174710-A1 COMPOUNDS THAT ARE S1P MODULATING AGENTS AND/OR ATX MODULATING AGENTS ENPP2, S1PR1, S1PR2 SLC18A3 1090/4885SIGMAR1 1625/4885GRIN2B 1364/4885
US-20160244408-A1 CARBAZOLE DERIVATIVES ACTING ON 5-HT7 RECEPTOR HTR7, HTR3A, HTR3B SLC18A3 578/4885SIGMAR1 200/4885GRIN2B 388/4885

“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.