SCHEMBL4416728

SCHEMBL4416728

Cc1cc2ccc3ccsc3c2s1

nearest known ligand 0.33

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
CYP2A6 P11509 1/20 0.33
MAPT P10636 1/20 0.32
TSHR P16473 1/20 0.32
ADORA2A P29274 1/20 0.30

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
SCHEMBL18195338 0.91 MAPT (0.31) MAPTTSHRADORA2A
SCHEMBL19130676 0.86 MAPT (0.33) CYP2A6MAPTTSHRADORA2A
SCHEMBL18133641 0.85 MAPT (0.32) CYP2A6MAPTTSHRADORA2A
SCHEMBL12279085 0.85 MAPT (0.32) CYP2A6MAPTTSHRADORA2A
SCHEMBL4420846 0.84 CYP2A6 (0.36) CYP2A6MAPT
SCHEMBL793638 0.76 CYP2A6 (0.46) CYP2A6ADORA2A
SCHEMBL4428271 0.75 CYP2A6 (0.33) CYP2A6
SCHEMBL4419842 0.75 CYP2A6 (0.33) CYP2A6
SCHEMBL22504302 0.75 ALDH1A1 (0.38) CYP2A6MAPTTSHR
SCHEMBL22504308 0.75 MAPT (0.46) CYP2A6MAPTTSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7351266-B2 Keratin dyeing compounds, keratin dyeing compositions containing them, and use thereof THE PROCTER & GAMBLE COMPANY (US) 2008-04-01 US claimed
US-20050193504-A1 Keratin dyeing compounds, keratin dyeing compositions containing them, and use thereof PROCTER & GAMBLE COMPANY, THE 2005-09-08 US claimed
US-11778893-B2 Indaceno derivatives as organic semiconductors CLAP CO., LTD. (KR) 2023-10-03 US disclosed
US-11778893-B2 Indaceno derivatives as organic semiconductors CLAP CO., LTD. (KR) 2023-10-03 US disclosed
EP-3762980-B1 ORGANIC FIELD EFFECT TRANSISTOR COMPRISING SEMICONDUCTING SINGLE-WALLED CARBON NANOTUBES AND ORGANIC SEMICONDUCTING MATERIAL CLAP CO LTD (KR) 2023-08-09 EP disclosed
US-11667650-B2 Thieno-indeno-monomers and polymers CLAP CO., LTD. (KR) 2023-06-06 US disclosed
US-11667650-B2 Thieno-indeno-monomers and polymers CLAP CO., LTD. (KR) 2023-06-06 US disclosed
US-20220041617-A1 THIENO-INDENO-MONOMERS AND POLYMERS BASF SE (DE) 2022-02-10 US disclosed
US-20210384434-A1 INDACENO DERIVATIVES AS ORGANIC SEMICONDUCTORS CLAP CO., LTD. (KR) 2021-12-09 US disclosed
EP-3423455-B1 SEMICONDUCTING POLYMER CLAP CO LTD (KR) 2021-06-23 EP disclosed
US-10815236-B2 Semiconducting polymer CLAP CO., LTD. (KR) 2020-10-27 US disclosed
WO-2015004563-A1 AZIDE-BASED CROSSLINKING AGENTS BASF SE (DE) 2015-01-15 WO disclosed
WO-2013060702-A1 PHOTOLUMINESCENT COMPOUND OR MIXTURE OF PHOTOLUMINESCENT COMPOUNDS ENI S.P.A. (IT) 2013-05-02 WO disclosed
EP-1720615-B1 COSMETIC HAIR DYEING COMPOSITIONS CONTAINING THEM AND USE THEREOF PROCTER & GAMBLE (US) 2009-12-30 EP disclosed
US-7468080-B2 Keratin dyeing compounds, keratin dyeing compositions containing them, and use thereof THE PROCTER & GAMBLE COMPANY (US) 2008-12-23 US disclosed
US-20080134450-A1 Keratin Dyeing Compounds, Keratin Dyeing Compositions Containing Them, And Use Thereof WELLA OPERATIONS US, LLC 2008-06-12 US disclosed
US-7351266-B2 Keratin dyeing compounds, keratin dyeing compositions containing them, and use thereof THE PROCTER & GAMBLE COMPANY (US) 2008-04-01 US disclosed
EP-1720615-A1 KERATIN DYEING COMPOUNDS, KERATIN DYEING COMPOSITIONS CONTAINING THEM, AND USE THEREOF The Procter and Gamble Company (US) 2006-11-15 EP disclosed
WO-2005087187-A1 KERATIN DYEING COMPOUNDS, KERATIN DYEING COMPOSITIONS CONTAINING THEM, AND USE THEREOF THE PROCTER & GAMBLE COMPANY (US) 2005-09-22 WO disclosed
US-20050193504-A1 Keratin dyeing compounds, keratin dyeing compositions containing them, and use thereof PROCTER & GAMBLE COMPANY, THE 2005-09-08 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 (7 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-10815236-B2 Semiconducting polymer NR1I3, NR1H3, NR1H2 CYP2A6 168/4885MAPT 1991/4885TSHR 2606/4885
US-20050193504-A1 Keratin dyeing compounds, keratin dyeing compositions containing them, and use thereof KRT18, CKMT1A; CKMT1B, KRTCAP2 CYP2A6 405/4885MAPT 446/4885TSHR 4706/4885
US-11667650-B2 Thieno-indeno-monomers and polymers RPS21, OXER1, OXSR1 CYP2A6 753/4885MAPT 3081/4885TSHR 81/4885
US-20210384434-A1 INDACENO DERIVATIVES AS ORGANIC SEMICONDUCTORS IPO11, CYP1B1, IDO1 CYP2A6 1095/4885MAPT 2054/4885TSHR 4716/4885
US-20220041617-A1 THIENO-INDENO-MONOMERS AND POLYMERS RPS21, OXER1, OXSR1 CYP2A6 753/4885MAPT 3081/4885TSHR 81/4885
US-20080134450-A1 Keratin Dyeing Compounds, Keratin Dyeing Compositions Containing Them, And Use Thereof KRT18, CKMT1A; CKMT1B, KRTCAP2 CYP2A6 405/4885MAPT 446/4885TSHR 4706/4885
US-11778893-B2 Indaceno derivatives as organic semiconductors IPO11, CYP1B1, IDO1 CYP2A6 1095/4885MAPT 2054/4885TSHR 4716/4885

“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.